SCHEMBL1371004

SCHEMBL1371004

CC(=O)[C@H](C)NC(=O)OC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA7 P43166 1/20 0.52
CYP2D6 P10635 1/20 0.46
KMT2A Q03164 2/20 0.44
CTSK P43235 8/20 0.44
CTSS P25774 4/20 0.44
CA12 O43570 1/20 0.43
CA14 Q9ULX7 1/20 0.43
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
GLA P06280 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
GLS O94925 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1369240 1.00 CA1 (0.52) CA1CA2CA7CYP2D6KMT2A
SCHEMBL1563568 1.00 CA1 (0.52) CA1CA2CA7CYP2D6KMT2A
SCHEMBL20131845 0.92 KMT2A (0.47) CA1CA2CA7CYP2D6KMT2A
SCHEMBL29068653 0.83 CA1 (0.49) CA1CA2CA7CYP2D6KMT2A
SCHEMBL15947338 0.83 CA1 (0.49) CA1CA2CA7CYP2D6KMT2A
SCHEMBL23849248 0.83 CA1 (0.52) CA1CA2CA7CYP2D6KMT2A
SCHEMBL148099 0.83 CA1 (0.52) CA1CA2CA7CYP2D6KMT2A
SCHEMBL256594 0.83 CA1 (0.52) CA1CA2CA7CYP2D6KMT2A
SCHEMBL23607312 0.83 CA1 (0.52) CA1CA2CA7CYP2D6KMT2A
SCHEMBL148100 0.83 CA1 (0.52) CA1CA2CA7CYP2D6KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 133 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240336596-A1 PARP7 INHIBITOR AND USE THEREOF NOVOSTAR PHARMACEUTICALS, LTD. (CN) 2024-10-10 US disclosed
EP-4338737-A1 PARP7 INHIBITOR AND USE THEREOF Novostar Pharmaceuticals, Ltd. (CN) 2024-03-20 EP disclosed
US-11813306-B2 Cyclic tetramer compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders NOVARTIS AG (CH) 2023-11-14 US disclosed
US-20230295112-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2023-09-21 US disclosed
US-20230295112-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2023-09-21 US disclosed
WO-2023137113-A2 CHEMICALLY REVERSIBLE 2´-OH ACYLATION PROTECTS RNA FROM HYDROLYTIC AND ENZYMATIC DEGRADATION THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2023-07-20 WO disclosed
US-11655257-B2 MK2 inhibitors, synthesis thereof, and intermediates thereto CELGENE CAR LLC (BM) 2023-05-23 US disclosed
US-11639334-B2 Methods for synthesis of oxypicolinamides CORTEVA AGRISCIENCE LLC (US) 2023-05-02 US disclosed
US-11623927-B2 Substituted [1,2,4]triazolo[1,5-a]pyrimidines for stabilizing microtubules THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2023-04-11 US disclosed
US-11623927-B2 Substituted [1,2,4]triazolo[1,5-a]pyrimidines for stabilizing microtubules THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2023-04-11 US disclosed
US-20080249131-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS ARDEA BIOSCIENCES, INC. (US) 2008-10-09 US disclosed
EP-1294747-B1 SYNTHETIC METHODS FOR APLIDINE AND NEW ANTITUMORAL DERIVATIVES, METHODS OF MAKING AND USING THEM PHARMA MAR SA (ES) 2008-04-30 EP disclosed
US-7348310-B2 Synthetic methods for aplidine and new antitumoral derivatives, methods of making and using them PHARMA MAR, S.A. (ES) 2008-03-25 US disclosed
US-20080045718-A1 Process and intermediates for the synthesis of 2-(quinolin-5-yl)-4,5 disubstituted-azole derivatives MERCK SHARP & DOHME CORP. 2008-02-21 US disclosed
US-20080009026-A1 FLUOROGENIC PROTEIN KINASE SUBSTRATES INVITROGEN CORPORATION (US) 2008-01-10 US disclosed
US-20080009435-A1 Synthetic methods for aplidine and new antitumoral derivatives, methods of making and using them PHARMA MAR, S.A., A SPAIN CORPORATION 2008-01-10 US disclosed
US-20080009435-A1 Synthetic methods for aplidine and new antitumoral derivatives, methods of making and using them PHARMA MAR, S.A., A SPAIN CORPORATION 2008-01-10 US disclosed
US-20070281962-A2 Administering 1,2,3,6-tetrasubstituted pyrido[3,4-b]indoles to inhibit the 5'-untranslated region-dependent translation; anticarcinogenic agents; retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, macular degeneration PCT THERAPEUTICS, INC. (US) 2007-12-06 US disclosed
US-20070276017-A1 Thiadiazoline Derivative KYOWA HAKKO KIRIN CO., LTD. (JP) 2007-11-29 US disclosed
CN-1443173-A Substituted imidazoles as TAFI a inhibitors PFIZER LTD (US) 2003-09-17 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11623927-B2 Substituted [1,2,4]triazolo[1,5-a]pyrimidines for stabilizing microtubules TUBB1, TUBA1B, TUBA1C CA1 3852/4885CA2 4304/4885CA7 4057/4885
US-11813306-B2 Cyclic tetramer compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders PCSK9, PCSK7, PCSK6 CA1 3165/4885CA2 3259/4885CA7 3861/4885
US-20070276017-A1 Thiadiazoline Derivative BRD7, NR3C2, NR5A2 CA1 4657/4885CA2 3840/4885CA7 1454/4885
US-20080249131-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS POLRMT, TYMP, RNGTT CA1 3827/4885CA2 4265/4885CA7 3720/4885
US-20240336596-A1 PARP7 INHIBITOR AND USE THEREOF PARP1, PARP3, PARP11 CA1 3814/4885CA2 3940/4885CA7 414/4885
US-20080009435-A1 Synthetic methods for aplidine and new antitumoral derivatives, methods of making and using them MCL1, APLNR, PAICS CA1 993/4885CA2 4013/4885CA7 850/4885
US-20230295112-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS VHL, FANCI, PAH CA1 4685/4885CA2 3104/4885CA7 2245/4885
US-20070281962-A2 Administering 1,2,3,6-tetrasubstituted pyrido[3,4-b]indoles to inhibit the 5'-untranslated region-dependent translation; anticarcinogenic agents; retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, macular degeneration VEGFA, FLT4, MIF CA1 4844/4885CA2 4487/4885CA7 4692/4885
US-11655257-B2 MK2 inhibitors, synthesis thereof, and intermediates thereto WEE2, WEE1, CDK2 CA1 3429/4885CA2 2645/4885CA7 3885/4885
US-20080045718-A1 Process and intermediates for the synthesis of 2-(quinolin-5-yl)-4,5 disubstituted-azole derivatives PDE4B, PDE4A, PDE3B CA1 2955/4885CA2 491/4885CA7 356/4885
US-11639334-B2 Methods for synthesis of oxypicolinamides CYP51A1, CYP4X1, CYP4F3 CA1 1613/4885CA2 445/4885CA7 777/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.