SCHEMBL9006684

SCHEMBL9006684

O=C=Nc1ccc(C=C2CCCC(=Cc3ccc(OC(F)=C(F)F)cc3)C2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 0.48
HSD11B1 P28845 2/20 0.45
F3 P13726 2/20 0.45
CYP2C9 P11712 1/20 0.45
EGFR P00533 5/20 0.43
MAPT P10636 3/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HTT P42858 2/20 0.42
HPGD P15428 1/20 0.42
MGAM O43451 2/20 0.41
GAA P10253 2/20 0.41
SI P14410 2/20 0.41
MGAM2 Q2M2H8 2/20 0.41
F2 P00734 3/20 0.40
F10 P00742 3/20 0.40
NPC1 O15118 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
SCHEMBL9006681 1.00 CYP1A2 (0.48) CYP1A2HSD11B1F3CYP2C9EGFR
SCHEMBL9006660 0.88 CYP1A2 (0.60) CYP1A2HSD11B1F3CYP2C9EGFR
SCHEMBL9006653 0.88 CYP1A2 (0.60) CYP1A2HSD11B1F3CYP2C9EGFR
SCHEMBL9006554 0.85 MAPT (0.42) CYP1A2EGFRMAPTMEN1ALDH1A1
SCHEMBL9006547 0.85 MAPT (0.42) CYP1A2EGFRMAPTMEN1ALDH1A1
SCHEMBL9006733 0.83 CYP2C9 (0.68) CYP1A2HSD11B1F3CYP2C9EGFR
SCHEMBL9006727 0.83 CYP2C9 (0.68) CYP1A2HSD11B1F3CYP2C9EGFR
SCHEMBL9006531 0.82 CYP1A2 (0.54) CYP1A2HSD11B1F3CYP2C9EGFR
SCHEMBL9006539 0.82 CYP1A2 (0.54) CYP1A2HSD11B1F3CYP2C9EGFR
SCHEMBL9006759 0.80 KMT2A (0.36) MAPTMEN1KMT2ATDP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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
EP-0676062-A1 PHOTODEFINABLE POLYMERS CONTAINING PERFLUOROCYCLOBUTANE GROUPS THE DOW CHEMICAL COMPANY (US) 1995-10-11 EP 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
WO-1994015258-A1 PHOTODEFINABLE POLYMERS CONTAINING PERFLUOROCYCLOBUTANE GROUPS THE DOW CHEMICAL COMPANY (US) 1994-07-07 WO disclosed