SCHEMBL9818930

SCHEMBL9818930

CC1CC(=O)c2cc(Cl)c(F)cc2O1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.53
AKR1B1 P15121 2/20 0.44
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
MAOB P27338 10/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
GAA P10253 2/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 2/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
ALPL P05186 1/20 0.37
POLB P06746 1/20 0.37
ALPI P09923 1/20 0.37
ALPG P10696 1/20 0.37
THRB P10828 1/20 0.37
APEX1 P27695 1/20 0.37
RECQL P46063 1/20 0.37
GCGR P47871 1/20 0.37

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
SCHEMBL9818870 0.95 PBRM1 (0.51) PBRM1AKR1B1CNR1CNR2MAOB
SCHEMBL9818866 0.95 PBRM1 (0.51) PBRM1AKR1B1CNR1CNR2MAOB
SCHEMBL9819356 0.88 PBRM1 (0.57) PBRM1AKR1B1MAOBKDM4EALDH1A1
SCHEMBL9819094 0.86 PBRM1 (0.58) PBRM1AKR1B1CNR1CNR2MAOB
SCHEMBL9818879 0.86 PBRM1 (0.58) PBRM1AKR1B1CNR1CNR2MAOB
SCHEMBL10713025 0.83 PBRM1 (0.55) PBRM1AKR1B1CNR1CNR2MAOB
SCHEMBL9818901 0.83 PBRM1 (0.51) PBRM1MAOBKDM4EALDH1A1GAA
Lithium Ion SCHEMBL10713022 0.82 PBRM1 (0.54) PBRM1AKR1B1CNR1CNR2MAOB
SCHEMBL9819184 0.81 PBRM1 (0.53) PBRM1CNR1CNR2MAOBKDM4E
SCHEMBL9819284 0.81 PBRM1 (0.60) PBRM1AKR1B1CNR1CNR2MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0230379-B1 CHROMAN- AND THIOCHROMAN-4-ACETIC ACIDS USEFUL IN THE TREATMENT OF DIABETIC COMPLICATIONS PFIZER INC. (US) 1991-04-03 EP disclosed
US-4853410-A Hydroxyacetic acid derivatives for the treatment of diabetic complications PFIZER INC. (US) 1989-08-01 US disclosed
WO-1987004344-A1 HYDROXYACETIC ACID DERIVATIVES FOR THE TREATMENT OF DIABETIC COMPLICATIONS PFIZER INC. (US) 1987-07-30 WO disclosed
EP-0230379-A2 Chroman- and thiochroman-4-acetic acids useful in the treatment of diabetic complications PFIZER INC. (US) 1987-07-29 EP disclosed