SCHEMBL4865262

SCHEMBL4865262

C=Cc1ccccc1C=C.CC=C(C)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.48
KDM4E B2RXH2 1/20 0.44
CYP2C9 P11712 1/20 0.42
HTT P42858 1/20 0.41
MAPT P10636 1/20 0.41
ALDH1A1 P00352 3/20 0.39
APEX1 P27695 7/20 0.38
AKT1 P31749 1/20 0.38
LMNA P02545 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
SCHEMBL7747003 1.00 AKR1C3 (0.48) AKR1C3KDM4ECYP2C9HTTMAPT
Styrene SCHEMBL22399380 0.93 AKR1C3 (0.52) AKR1C3KDM4ECYP2C9HTTMAPT
Styrene SCHEMBL11433472 0.93 AKR1C3 (0.52) AKR1C3KDM4ECYP2C9HTTMAPT
SCHEMBL8928653 0.89 AKR1C3 (0.43) AKR1C3KDM4ECYP2C9HTTMAPT
SCHEMBL11880751 0.89 AKR1C3 (0.43) AKR1C3KDM4ECYP2C9HTTMAPT
Styrene SCHEMBL17080378 0.87 AKR1C3 (0.46) AKR1C3KDM4ECYP2C9HTTMAPT
SCHEMBL28588058 0.86 AKR1C3 (0.57) AKR1C3KDM4ECYP2C9HTTALDH1A1
SCHEMBL14040079 0.86 AKR1C3 (0.57) AKR1C3KDM4ECYP2C9HTTALDH1A1
Styrene SCHEMBL238869 0.84 AKR1C3 (0.59) AKR1C3CYP2C9HTTMAPTALDH1A1
Styrene SCHEMBL134355 0.84 AKR1C3 (0.59) AKR1C3CYP2C9HTTMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103524653-B The preparation of polymeric hollow microsphere 南亚塑胶工业股份有限公司 2016-09-21 CN disclosed
US-7427467-B2 Silver salt photothermographic dry imaging material KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-09-23 US disclosed
EP-1717635-A1 Silver salt photothermographic dry imaging material Konica Minolta Medical & Graphic Inc. (JP) 2006-11-02 EP disclosed
US-20060240367-A1 Silver salt photothermographic dry imaging material KONICA MINOLTA MEDICAL & GRAPHIC, INC. 2006-10-26 US disclosed
US-4132762-A AGAINST TRANSITION METAL IMPURITIES BY SYNERGISTIC COMBINATION OF ACETONITRILE AND ACIDIC ION EXCHANGE RESIN SHELL OIL COMPANY (US) 1979-01-02 US disclosed
US-3969433-A ADDITION POLYMER KOSE AKIRA 1976-07-13 US disclosed