SCHEMBL500459

SCHEMBL500459

COC(=O)C(N)C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.42
DPP4 P27487 6/20 0.41
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
PTGS1 P23219 1/20 0.37
CA14 Q9ULX7 3/20 0.37
CA12 O43570 2/20 0.37
DGAT1 O75907 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
KMT2A Q03164 1/20 0.32
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31
FAP Q12884 1/20 0.31
DPP8 Q6V1X1 1/20 0.31
DPP9 Q86TI2 1/20 0.31
DPP7 Q9UHL4 1/20 0.31

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
SCHEMBL20879474 1.00 SMN1; SMN2 (0.42) SMN1; SMN2DPP4ALDH1A1MAPTPTGS1
SCHEMBL500460 1.00 SMN1; SMN2 (0.42) SMN1; SMN2DPP4ALDH1A1MAPTPTGS1
Hydrochloric Acid SCHEMBL29398329 0.97 SMN1; SMN2 (0.41) SMN1; SMN2DPP4ALDH1A1MAPTPTGS1
Hydrochloric Acid SCHEMBL1705950 0.97 SMN1; SMN2 (0.41) SMN1; SMN2DPP4ALDH1A1MAPTPTGS1
Hydrochloric Acid SCHEMBL737492 0.97 SMN1; SMN2 (0.41) SMN1; SMN2DPP4ALDH1A1MAPTPTGS1
SCHEMBL3015800 0.82 SMN1; SMN2 (0.39) SMN1; SMN2DPP4ALDH1A1MAPTPTGS1
SCHEMBL16147546 0.82 SMN1; SMN2 (0.39) SMN1; SMN2DPP4ALDH1A1MAPTPTGS1
SCHEMBL255215 0.82 SMN1; SMN2 (0.39) SMN1; SMN2DPP4ALDH1A1MAPTPTGS1
SCHEMBL16821022 0.82 SMN1; SMN2 (0.39) SMN1; SMN2DPP4ALDH1A1MAPTPTGS1
SCHEMBL7540176 0.81 ALDH1A1 (0.39) DPP4ALDH1A1MAPTPTGS1FAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2215076-A2 COMPOUNDS THAT INHIBIT PROTEASE CATHEPSIN S AND HCV REPLICATION Virobay, Inc. (US) 2010-08-11 EP claimed
US-20090270415-A1 COMPOUNDS THAT INHIBIT PROTEASE CATHEPSIN S AND HCV REPLICATION VIROBAY, INC. (US) 2009-10-29 US claimed
WO-2009055467-A2 COMPOUNDS THAT INHIBIT PROTEASE CATHEPSIN S AND HCV REPLICATION VIROBAY, INC. (US) 2009-04-30 WO claimed
WO-2026102082-A1 ALKYLPHENYL SUBSTITUTED COMPOUNDS, COMPOSITIONS AND METHODS OF USE DEEP APPLE THERAPEUTICS, INC. (US) 2026-05-15 WO disclosed
US-20260132119-A1 Alkylphenyl Substituted Compounds, Compositions and Methods of Use DEEP APPLE THERAPEUTICS, INC. (US) 2026-05-14 US disclosed
US-12109219-B2 Cannabinoid receptor modulators ARENA PHARMACEUTICALS, INC. (US) 2024-10-08 US disclosed
US-20240208992-A1 MACROCYCLES AS CFTR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2024-06-27 US disclosed
EP-4308575-A1 MACROCYCLES AS CFTR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2024-01-24 EP disclosed
CN-116981672-A Macrocyclic compounds as CFTR modulators 爱杜西亚药品有限公司 2023-10-31 CN disclosed
US-11771695-B2 Cannabinoid receptor modulators ARENA PHARMACEUTICALS, INC. (US) 2023-10-03 US disclosed
US-11746091-B2 Cannabinoid receptor modulators ARENA PHARMACEUTICALS, INC. (US) 2023-09-05 US disclosed
EP-1250340-B1 METHODS AND COMPOUNDS FOR INHIBITING MRP1 LILLY CO ELI (US) 2004-11-17 EP disclosed
US-6743794-B2 MULTIDRUG RESISTANCE PROTEIN; CANCER; 3-(9-CHLORO-3-METHYL-4-OXO-5H-ISOXAZOLO(4,3-C)QUINOLIN-5-YL)) CYCLOHEXYL)-2-PIPERIDYLACETAMIDE ELI LILLY AND COMPANY 2004-06-01 US disclosed
US-20030100576-A1 Methods and compounds for inhibiting mrp1 ELI LILLY AND COMPANY 2003-05-29 US disclosed
EP-1250340-A1 METHODS AND COMPOUNDS FOR INHIBITING MRP1 ELI LILLY AND COMPANY (US) 2002-10-23 EP disclosed
CN-1310179-A Oxamide being as IMPDH inhibitor HOFFMANN LA ROCHE (CH) 2001-08-29 CN disclosed
WO-2001046199-A1 METHODS AND COMPOUNDS FOR INHIBITING MRP1 ELI LILLY AND COMPANY (US) 2001-06-28 WO disclosed
EP-0712390-B1 SUCCINAMIDE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS GELATINASE AND COLLAGENASE INHIBITORS CELLTECH THERAPEUTICS LTD (GB) 1998-12-09 EP disclosed
US-5827890-A ANGIOGENESIS INHIBITORS CELLTECH THERAPEUTICS LTD. (GB) 1998-10-27 US disclosed
WO-1995004033-A1 SUCCINAMIDE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS GELATINASE AND COLLAGENASE INHIBITORS CELLTECH LIMITED (GB) 1995-02-09 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 (7 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-20090270415-A1 COMPOUNDS THAT INHIBIT PROTEASE CATHEPSIN S AND HCV REPLICATION CTSS, CTSV, CTSE SMN1; SMN2 3554/4885DPP4 120/4885ALDH1A1 3330/4885
US-20240208992-A1 MACROCYCLES AS CFTR MODULATORS CFTR, PKD1, ARRB1 SMN1; SMN2 3983/4885DPP4 3928/4885ALDH1A1 2257/4885
US-20260132119-A1 Alkylphenyl Substituted Compounds, Compositions and Methods of Use GIPR, MC2R, GRPR SMN1; SMN2 881/4885DPP4 267/4885ALDH1A1 3360/4885
US-11746091-B2 Cannabinoid receptor modulators CNR1, CNR2, TRPV1 SMN1; SMN2 208/4885DPP4 4074/4885ALDH1A1 3623/4885
US-20030100576-A1 Methods and compounds for inhibiting mrp1 ABCC1, ABCB11, ABCB1 SMN1; SMN2 4221/4885DPP4 1737/4885ALDH1A1 264/4885
US-11771695-B2 Cannabinoid receptor modulators CNR2, CNR1, OPRL1 SMN1; SMN2 2187/4885DPP4 4488/4885ALDH1A1 2692/4885
US-12109219-B2 Cannabinoid receptor modulators CNR1, CNR2, GPR18 SMN1; SMN2 4018/4885DPP4 4760/4885ALDH1A1 2571/4885

“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.