SCHEMBL478909

SCHEMBL478909

CC(C)CC(C(=O)O)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.64
GAA P10253 2/20 0.64
POLB P06746 4/20 0.62
TP53 P04637 2/20 0.62
KDM4E B2RXH2 1/20 0.62
GLA P06280 1/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2D6 P10635 1/20 0.62
HPGD P15428 1/20 0.62
ALOX12 P18054 1/20 0.62
NFKB1 P19838 1/20 0.62
APEX1 P27695 1/20 0.62
MAPK1 P28482 1/20 0.62
HSD17B10 Q99714 1/20 0.62
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
TAAR1 Q96RJ0 1/20 0.56
BCL2 P10415 2/20 0.54
BCL2L2 Q92843 2/20 0.54
MAPT P10636 1/20 0.54

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
SCHEMBL4609039 1.00 ALDH1A1 (0.64) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL11616001 1.00 ALDH1A1 (0.64) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL16656338 0.88 ALDH1A1 (0.49) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL27883350 0.87 ALDH1A1 (0.59) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL25583427 0.86 KDM4E (0.58) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL9449206 0.86 LMNA (0.65) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL5422287 0.85 ALDH1A1 (0.60) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL12291598 0.85 ALDH1A1 (0.60) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL6689063 0.85 ALDH1A1 (0.63) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL19359464 0.85 ALDH1A1 (0.63) ALDH1A1GAAPOLBTP53KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723425-B2 Pigment compositions with modified ATRP copolymer dispersants CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-05-25 US claimed
EP-1477486-A2 Imides as inhibitors of TNF alpha CELGENE CORPORATION (US) 2004-11-17 EP claimed
US-11998901-B2 Metal complex, method for producing same, and method for producing gamma-lactam compound using same INSTITUTE FOR BASIC SCIENCE (KR) 2024-06-04 US disclosed
US-20230312577-A1 DUAL KINASE-BROMODOMAIN INHIBITORS MONASH UNIVERSITY (AU) 2023-10-05 US disclosed
CN-111566116-B Novel metal complex, process for producing the same, and process for producing gamma-lactam compound using the same 基础科学研究院 2023-06-09 CN disclosed
US-20220168717-A1 NOVEL METAL COMPLEX, METHOD FOR PRODUCING SAME, AND METHOD FOR PRODUCING GAMMA-LACTAM COMPOUND USING SAME INSTITUTE FOR BASIC SCIENCE (KR) 2022-06-02 US disclosed
US-11344872-B2 Metal complex, method for producing same, and method for producing gamma-lactam compound using same INSTITUTE FOR BASIC SCIENCE (KR) 2022-05-31 US disclosed
US-20200330969-A1 NOVEL METAL COMPLEX, METHOD FOR PRODUCING SAME, AND METHOD FOR PRODUCING GAMMA-LACTAM COMPOUND USING SAME KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2020-10-22 US disclosed
CN-111566116-A Novel metal complex, method for producing same, and method for producing gamma-lactam compound using same 基础科学研究院 2020-08-21 CN disclosed
US-10138236-B2 Factor xia-inhibiting pyridobenzazepine and pyridobenzazocine derivatives BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-11-27 US disclosed
EP-3197891-B1 FACTOR XIA-INHIBITING PYRIDOBENZAZEPINE AND PYRIDOBENZAZOCINE DERIVATIVES Bayer Pharma AG (DE) 2018-11-21 EP disclosed
US-5605914-A INHIBITORS OF TUMOR NECROSIS FACTOR CELGENE CORPORATION (US) 1997-02-25 US disclosed
EP-0706521-A1 NOVEL IMIDES CELGENE CORPORATION (US) 1996-04-17 EP disclosed
US-5463063-A Preparation of thalidomide; inhibitor of tumor necrosis factor CELGENE CORPORATION (US) 1995-10-31 US disclosed
WO-1995001348-A2 IMIDES AS INHIBITORS OF TNP ALPHA CELGENE CORPORATION (US) 1995-01-12 WO disclosed
US-5250546-A Administering as therapy for spastic paralysis; glutamic acid blocking agent; agricultural chemicals NIPPON CHEMIPHAR CO., LTD. (JP) 1993-10-05 US disclosed
EP-0177245-B1 AMINO-ALCOHOL DERIVATIVES AND PROCESSES FOR THEIR PREPARATION NIPPON CHEMIPHAR CO., LTD. (JP) 1991-04-10 EP disclosed
US-4644063-A MUSCLE RELAXANTS; AGRICULTURE NIPPON CHEMIPHAR CO., LTD. (JP) 1987-02-17 US disclosed
EP-0208666-A1 Improvements to explosive charges Nobel Kemi AB (SE) 1987-01-14 EP disclosed
EP-0177245-A2 Amino-alcohol derivatives and processes for their preparation NIPPON CHEMIPHAR CO., LTD. (JP) 1986-04-09 EP 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 (6 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-10138236-B2 Factor xia-inhibiting pyridobenzazepine and pyridobenzazocine derivatives F13B, TFPI, TFPI2 ALDH1A1 3966/4885GAA 2228/4885POLB 3568/4885
US-20220168717-A1 NOVEL METAL COMPLEX, METHOD FOR PRODUCING SAME, AND METHOD FOR PRODUCING GAMMA-LACTAM COMPOUND USING SAME COASY, NOTUM, MRPL21 ALDH1A1 2634/4885GAA 132/4885POLB 1168/4885
US-11344872-B2 Metal complex, method for producing same, and method for producing gamma-lactam compound using same COASY, NOTUM, MRPL21 ALDH1A1 2316/4885GAA 105/4885POLB 1090/4885
US-11998901-B2 Metal complex, method for producing same, and method for producing gamma-lactam compound using same COASY, NOTUM, MRPL21 ALDH1A1 2316/4885GAA 105/4885POLB 1090/4885
US-20230312577-A1 DUAL KINASE-BROMODOMAIN INHIBITORS MAP2K2, BRPF3, BRDT ALDH1A1 4173/4885GAA 3101/4885POLB 1099/4885
US-20200330969-A1 NOVEL METAL COMPLEX, METHOD FOR PRODUCING SAME, AND METHOD FOR PRODUCING GAMMA-LACTAM COMPOUND USING SAME COASY, NOTUM, MRPL21 ALDH1A1 2634/4885GAA 132/4885POLB 1168/4885

“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.