SCHEMBL7931695

SCHEMBL7931695

FC(F)(F)c1ccc(CC2=CC=CC2)c(C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLQ O75417 9/20 0.39
DAO P14920 1/20 0.38
CES2 O00748 2/20 0.36
SLC6A4 P31645 2/20 0.34
TACR1 P25103 1/20 0.33
IDO1 P14902 1/20 0.33
SRD5A1 P18405 1/20 0.32
HTR2A P28223 1/20 0.32
KCNH2 Q12809 1/20 0.32
PDE2A O00408 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL7931720 0.76 TAAR1 (0.40) IDO1KDM4EALDH1A1
SCHEMBL22024030 0.74 HTR2B (0.47) DAOSLC6A4IDO1HTR2AKDM4E
SCHEMBL4416164 0.71 POLQ (0.51) POLQDAOCES2IDO1PDE2A
SCHEMBL7933391 0.71 DAO (0.36) POLQDAOCES2SLC6A4TACR1
SCHEMBL1538523 0.70 DAO (0.49) POLQDAOCES2SLC6A4TACR1
SCHEMBL21446971 0.70 SLC6A4 (0.52) POLQDAOCES2SLC6A4HTR2A
SCHEMBL5255556 0.69 POLQ (0.50) POLQDAOCES2TACR1ALDH1A1
SCHEMBL1993639 0.69 CES2 (0.52) POLQDAOCES2IDO1
SCHEMBL13644756 0.68 POLQ (0.46) POLQDAOCES2IDO1PDE2A
SCHEMBL13349970 0.68 DAO (0.51) POLQDAOCES2IDO1PDE2A

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-0791607-B1 Substituted metallocene catalyst for the (co)polymerization of olefins ENICHEM SPA (IT) 2001-05-02 EP disclosed
US-5936051-A FORMING POLYMERS OF HIGH MOLECULAR WEIGHT; CHEMICAL AND HEAT RESISTANCE; ALUMOXANE COCATALYSTS ENICHEM S.P.A. (IT) 1999-08-10 US disclosed
EP-0791607-A2 Substituted metallocene catalyst for the (co)polymerization of olefins ENICHEM S.p.A. (IT) 1997-08-27 EP disclosed