SCHEMBL10794810

SCHEMBL10794810

O=C(NCc1ccc(OC(F)(F)C(Cl)Cl)cc1)NC(=O)c1c(F)cccc1F

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPIA P62937 1/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
MAPT P10636 1/20 0.43
ALOX15 P16050 1/20 0.43
KMT2A Q03164 1/20 0.43
OPRM1 P35372 1/20 0.42
HTR2C P28335 1/20 0.41
EPHX2 P34913 3/20 0.40
PPARA Q07869 1/20 0.40
ATM Q13315 1/20 0.40
TRPV1 Q8NER1 2/20 0.39
NAMPT P43490 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
ALDH2 P05091 1/20 0.39
TP53 P04637 1/20 0.39
ITGB1 P05556 1/20 0.37
ITGA4 P13612 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
SCHEMBL10798021 0.89 PPIA (0.43) PPIAOPRM1HTR2CEPHX2PPARA
SCHEMBL10795425 0.84 TDP1 (0.51) MEN1USP2MAPTALOX15KMT2A
SCHEMBL10798005 0.81 TDP1 (0.57) MEN1KMT2AEPHX2PPARATP53
SCHEMBL10795802 0.81 TDP1 (0.43) PPIAMAPTEPHX2PPARANAMPT
SCHEMBL11074228 0.79 MEN1 (0.38) MEN1KMT2AOPRM1HTR2CEPHX2
SCHEMBL10590200 0.79 MEN1 (0.56) MEN1USP2MAPTALOX15KMT2A
SCHEMBL11124656 0.79 EPHX2 (0.38) OPRM1HTR2CEPHX2PPARATRPV1
SCHEMBL10795641 0.77 RAB9A (0.52) MEN1USP2MAPTALOX15KMT2A
SCHEMBL11073508 0.77 CNR1 (0.36) MEN1KMT2AOPRM1HTR2CEPHX2
SCHEMBL11069978 0.77 EPHX2 (0.40) MEN1KMT2AOPRM1HTR2CEPHX2

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
US-RE32418-E INSECTICIDES THE DOW CHEMICAL COMPANY (US) 1987-05-12 US claimed
US-4170657-A INSECTICIDES THE DOW CHEMICAL COMPANY (US) 1979-10-09 US claimed
US-4431667-A Imino ethers useful for controlling insect and arachnoid pests THE UPJOHN COMPANY (US) 1984-02-14 US disclosed