SCHEMBL9818910

SCHEMBL9818910

CC1CC(=O)c2c(ccc(F)c2Br)O1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.51
AKR1B1 P15121 2/20 0.43
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 4/20 0.39
MAPT P10636 3/20 0.39
POLB P06746 2/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
ALPL P05186 1/20 0.39
ALPI P09923 1/20 0.39
GAA P10253 1/20 0.39
ALPG P10696 1/20 0.39
THRB P10828 1/20 0.39
APEX1 P27695 1/20 0.39
MAPK1 P28482 1/20 0.39
RECQL P46063 1/20 0.39
GCGR P47871 1/20 0.39
RAB9A P51151 1/20 0.39
VCP P55072 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL27207461 0.84 PBRM1 (0.46) PBRM1AKR1B1ALDH1A1KDM4EMAPT
SCHEMBL27203904 0.84 PBRM1 (0.46) PBRM1AKR1B1ALDH1A1KDM4EMAPT
SCHEMBL27203856 0.84 PBRM1 (0.46) PBRM1AKR1B1ALDH1A1KDM4EMAPT
SCHEMBL27203906 0.78 BRD4 (0.44) PBRM1ALDH1A1KDM4EMAPTPOLB
SCHEMBL25207401 0.71 KDM4E (0.47) PBRM1ALDH1A1KDM4EMAPTPOLB
SCHEMBL9819147 0.71 PBRM1 (0.46) PBRM1AKR1B1ALDH1A1KDM4EMAPT
SCHEMBL7609607 0.69 BRD4 (0.45) PBRM1ALDH1A1KDM4EMAPTPOLB
SCHEMBL30964228 0.69 BRD4 (0.45) PBRM1ALDH1A1KDM4EMAPTPOLB
SCHEMBL9819061 0.69 PBRM1 (0.59) PBRM1AKR1B1ALDH1A1KDM4EMAPT
SCHEMBL18013010 0.68 PBRM1 (1.00) PBRM1AKR1B1ALDH1A1KDM4EMAPT

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