SCHEMBL9006522

SCHEMBL9006522

COc1ccc(/C(C)=C/c2ccc(OC(F)=C(F)F)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 7/20 0.58
PTGS1 P23219 5/20 0.56
PTGS2 P35354 3/20 0.56
TUBB1 Q9H4B7 2/20 0.52
MAPT P10636 3/20 0.51
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 2/20 0.51
HPGD P15428 2/20 0.51
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
NFKB1 P19838 1/20 0.41
APEX1 P27695 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GFER P55789 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL9006563 1.00 NQO2 (0.58) NQO2PTGS1PTGS2TUBB1MAPT
SCHEMBL9006557 1.00 NQO2 (0.58) NQO2PTGS1PTGS2TUBB1MAPT
SCHEMBL9006527 1.00 NQO2 (0.58) NQO2PTGS1PTGS2TUBB1MAPT
SCHEMBL8935002 0.94 ESR1 (0.52) NQO2PTGS1PTGS2TUBB1MAPT
SCHEMBL8935004 0.94 ESR1 (0.52) NQO2PTGS1PTGS2TUBB1MAPT
SCHEMBL9006649 0.88 PTGS1 (0.48) NQO2PTGS1PTGS2TUBB1MAPT
SCHEMBL9006603 0.88 PTGS1 (0.48) NQO2PTGS1PTGS2TUBB1MAPT
SCHEMBL9006506 0.88 ESR1 (0.64) NQO2PTGS1PTGS2TUBB1ESR1
SCHEMBL9006643 0.88 PTGS1 (0.48) NQO2PTGS1PTGS2TUBB1MAPT
SCHEMBL9006606 0.88 PTGS1 (0.48) NQO2PTGS1PTGS2TUBB1MAPT

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-0676062-A1 PHOTODEFINABLE POLYMERS CONTAINING PERFLUOROCYCLOBUTANE GROUPS THE DOW CHEMICAL COMPANY (US) 1995-10-11 EP claimed
US-5426164-A Solvent and chemical resistant coatings and photoresists; photocuring of perfluorovinyl polymers containing photo active sites; cyclization THE DOW CHEMICAL COMPANY (US) 1995-06-20 US claimed
WO-1994015258-A1 PHOTODEFINABLE POLYMERS CONTAINING PERFLUOROCYCLOBUTANE GROUPS THE DOW CHEMICAL COMPANY (US) 1994-07-07 WO claimed
US-5489623-A APPLYING POLYMER TO SURFACE, EXPOSING TO INCIDENT PHOTONICRADIATION TO RENDER PORTIONS LESS SOLUBLE OR DISPERSIBLE THE DOW CHEMICAL COMPANY (US) 1996-02-06 US disclosed
US-5426164-A Solvent and chemical resistant coatings and photoresists; photocuring of perfluorovinyl polymers containing photo active sites; cyclization THE DOW CHEMICAL COMPANY (US) 1995-06-20 US disclosed