SCHEMBL1198901

SCHEMBL1198901

C[CH]N1CCc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
MAPT P10636 3/20 0.50
GAA P10253 1/20 0.50
USP2 O75604 1/20 0.48
CDK4 P11802 1/20 0.48
ALOX15 P16050 1/20 0.48
CCND1 P24385 1/20 0.48
NOTUM Q6P988 2/20 0.47
SIGMAR1 Q99720 1/20 0.46
KDM4E B2RXH2 2/20 0.44
THRB P10828 1/20 0.44
TSHR P16473 2/20 0.43
NPC1 O15118 1/20 0.43
TNNI3 P19429 1/20 0.43
HTT P42858 1/20 0.43
TNNT2 P45379 1/20 0.43
RAB9A P51151 1/20 0.43
TNNC1 P63316 1/20 0.43

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
SCHEMBL5537868 0.88 NOTUM (0.50) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL223608 0.79 MEN1 (0.54) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL2319502 0.79 MEN1 (0.50) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL782147 0.79 MEN1 (0.50) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL11804991 0.79 MEN1 (0.50) ALDH1A1MEN1KMT2AMAPTGAA
Methane SCHEMBL11307340 0.78 MEN1 (0.49) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL2596389 0.76 MEN1 (0.51) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL28545524 0.76 ALDH1A1 (0.44) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL16328733 0.73 MEN1 (0.52) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL20456233 0.73 MEN1 (0.49) ALDH1A1MEN1KMT2AMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103313989-A Tricyclic PI3K inhibitor compounds and methods of use HOFFMANN LA ROCHE 2013-09-18 CN claimed
US-20240239843-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC AND LIVER DISORDERS VIKING THERAPEUTICS, INC. 2024-07-18 US disclosed
CN-107921030-B Covalent linker of antibody-drug conjugate, preparation method and application thereof 荣昌生物制药(烟台)股份有限公司 2024-07-02 CN disclosed
CN-114939174-B Covalent linker of antibody-drug conjugate, preparation method and application thereof 荣昌生物制药(烟台)股份有限公司 2024-06-28 CN disclosed
CN-118265720-A Compositions and methods for treating metabolic disorders and liver diseases 维京治疗公司 2024-06-28 CN disclosed
US-12016868-B2 Boronic acid derivatives and therapeutic uses thereof QPEX BIOPHARMA, INC. (US) 2024-06-25 US disclosed
CN-118251218-A Combination therapy for treating cancer using PRMT5 inhibitors 米拉蒂医疗股份有限公司 2024-06-25 CN disclosed
US-20240197750-A1 CEFTIBUTEN DOSING REGIMENS QPEX BIOPHARMA INC (US) 2024-06-20 US disclosed
WO-2024124279-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF CERTA THERAPEUTICS PTY LTD (AU) 2024-06-20 WO disclosed
EP-3781576-B1 BORONIC ACID DERIVATIVES AND THERAPEUTIC USES THEREOF QPEX BIOPHARMA INC (US) 2024-06-12 EP disclosed
WO-2006060494-A1 HALOALKYL CONTAINING COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2006-06-08 WO disclosed
EP-1664003-A1 HALOALKYL CONTAINING COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2006-06-07 EP disclosed
EP-1663958-A2 HALOALKYL CONTAINING COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2006-06-07 EP disclosed
WO-2006034004-A2 PROCESSES AND INTERMEDIATES FOR PREPARING CYSTEINE PROTEASE INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2006-03-30 WO disclosed
WO-2005074904-A2 SILINANE COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2005-08-18 WO disclosed
US-20050182096-A1 Haloalkyl containing compounds as cysteine protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-08-18 US disclosed
WO-2005058348-A1 USE OF CATHEPSIN S INHIBITORS FOR TREATING AN IMMUNE RESPONSE CAUSED BY ADMINISTRATION OF A SMALL MOLECULE THERAPEUTIC OR BIOLOGIC AXYS PHARMACEUTICALS, INC. (US) 2005-06-30 WO disclosed
WO-2005028454-A1 HALOALKYL CONTAINING COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2005-03-31 WO disclosed
WO-2005028429-A2 HALOALKYL CONTAINING COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2005-03-31 WO disclosed
WO-2004108661-A1 AMIDINO COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS AXYS PHARMACEUTICALS (US) 2004-12-16 WO 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 (4 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-12016868-B2 Boronic acid derivatives and therapeutic uses thereof BCL6B, BCL6, BTD ALDH1A1 1981/4885MEN1 608/4885KMT2A 3882/4885
US-20240197750-A1 CEFTIBUTEN DOSING REGIMENS PEPD, NQO1, BTD ALDH1A1 3339/4885MEN1 4459/4885KMT2A 1775/4885
US-20240239843-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC AND LIVER DISORDERS GIPR, GLP1R, GPR119 ALDH1A1 2792/4885MEN1 1218/4885KMT2A 3614/4885
US-20050182096-A1 Haloalkyl containing compounds as cysteine protease inhibitors CTSF, CTSS, CTSE ALDH1A1 1944/4885MEN1 4684/4885KMT2A 4029/4885

“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.