SCHEMBL6937012

SCHEMBL6937012

CC(=NOC(C)O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.46
PDCD1 Q15116 1/20 0.45
CD274 Q9NZQ7 1/20 0.45
LMNA P02545 2/20 0.44
HTT P42858 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPK1 P28482 1/20 0.44
MAPT P10636 4/20 0.44
S1PR1 P21453 1/20 0.40
PKM P14618 2/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.38
CYP1A2 P05177 1/20 0.38
GAA P10253 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL8686175 0.86 CYP1A2 (0.43) SMN1; SMN2LMNAHTTL3MBTL1MAPK1
SCHEMBL8686093 0.85 PPARG (0.47) LMNAHTTL3MBTL1MAPK1MAPT
SCHEMBL8686025 0.85 SMN1; SMN2 (0.53) SMN1; SMN2LMNAL3MBTL1MAPTS1PR1
SCHEMBL8685836 0.82 MKNK1 (0.43) ALDH1A1
SCHEMBL8687119 0.81 S1PR1 (0.44) MAPTS1PR1
SCHEMBL8686143 0.81 LDHA (0.49) SMN1; SMN2LMNAHTTL3MBTL1MAPK1
SCHEMBL8686182 0.80 LMNA (0.43) SMN1; SMN2LMNAHTTL3MBTL1MAPK1
SCHEMBL8686358 0.79 MAPT (0.45) SMN1; SMN2PDCD1CD274LMNAHTT
SCHEMBL8685877 0.79 HIF1A (0.40) SMN1; SMN2
SCHEMBL8686485 0.77 PPARG (0.44) SMN1; SMN2LMNAMAPTALDH1A1NPC1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0916651-B1 PHENYLALKYLCARBOXYLIC ACID DERIVATIVES SANKYO CO (JP) 2003-10-15 EP disclosed
US-6103907-A ALDOSE REDUCTASE INHIBITING ANTIDIABETIC AGENT SANKYO COMPANY, LIMITED (JP) 2000-08-15 US disclosed
EP-0916651-A1 PHENYLALKYLCARBOXYLIC ACID DERIVATIVES Sankyo Company, Limited (JP) 1999-05-19 EP disclosed
US-5780490-A A O-(2,4-OXA(OR THIA)ZOLIDINYL)PHENYLOXY(OR THIO OR AMINO) ALKYLOXIME; ALDOSE REDUCTASE INHIBITORS; ANTIDIABETIC AND -HYPOGLYCEMIC AGENTS; LIVER, SKIN AND UROGENITAL DISORDERS SANKYO COMPANY, LIMITED (JP) 1998-07-14 US disclosed
US-5703096-A ANTIDIABETIC AGENTS; ALDOSE REDUCTASE INHIBITOR SANKYO COMPANY, LIMITED (JP) 1997-12-30 US disclosed