SCHEMBL6993314

SCHEMBL6993314

CC(=CC(Cl)(c1ccccc1)c1ccccc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.47
CYP1A2 P05177 2/20 0.45
APEX1 P27695 7/20 0.39
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 2/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
CYP2C9 P11712 1/20 0.38
KCNN4 O15554 1/20 0.37
CYP2C19 P33261 1/20 0.37
HIF1A Q16665 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36

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
SCHEMBL2072809 0.80 AKR1C3 (0.50) AKR1C3CYP1A2APEX1MAPTKMT2A
SCHEMBL6255791 0.80 AKR1C3 (0.50) AKR1C3CYP1A2APEX1MAPTKMT2A
SCHEMBL6930231 0.78 AKR1C3 (0.48) AKR1C3CYP1A2APEX1MAPTKMT2A
SCHEMBL9799297 0.78 AKR1C3 (0.48) AKR1C3CYP1A2APEX1MAPTKMT2A
SCHEMBL6930225 0.78 AKR1C3 (0.48) AKR1C3CYP1A2APEX1MAPTKMT2A
SCHEMBL1469914 0.78 AKR1C3 (0.48) AKR1C3CYP1A2APEX1MAPTKMT2A
SCHEMBL28381725 0.77 AKR1C3 (0.47) AKR1C3CYP1A2APEX1MAPTKMT2A
SCHEMBL8033838 0.77 AKR1C3 (0.47) AKR1C3CYP1A2APEX1MAPTKMT2A
SCHEMBL19656195 0.73 AKR1C3 (0.43) AKR1C3CYP1A2APEX1MAPTKMT2A
SCHEMBL11298115 0.72 AKR1C3 (0.42) AKR1C3CYP1A2MAPTKMT2ACYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0973636-B1 TRANSPARENT ARTICLE WITH RADIAL REFRACTIVE INDEX GRADIENT AND PROCESS FOR ITS MANUFACTURE ESSILOR INT (FR) 2003-01-02 EP claimed
EP-0973636-A1 TRANSPARENT ARTICLE WITH RADIAL REFRACTIVE INDEX GRADIENT AND PROCESS FOR ITS MANUFACTURE ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) 2000-01-26 EP claimed
WO-1998045108-A1 TRANSPARENT ARTICLE WITH RADIAL REFRACTIVE INDEX GRADIENT AND PROCESS FOR ITS MANUFACTURE ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) 1998-10-15 WO claimed