SCHEMBL7879895

SCHEMBL7879895

FC(F)(F)c1cc(I)cc(C(F)(F)F)c1C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.33
GAA P10253 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
GLA P06280 1/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL24573787 0.76 TMPRSS4 (0.33) GAAGLAPOLBTSHR
SCHEMBL6756054 0.74 CES2 (0.41) GAAALDH1A1GLAPOLBTSHR
SCHEMBL7872269 0.74 SOS1 (0.32) NOTUM
SCHEMBL23416481 0.73 GAA (0.35) GAAALDH1A1MAPTRAB9AGLA
SCHEMBL392404 0.72 TSHR (0.52) GAAALDH1A1MAPTRAB9AGLA
SCHEMBL7657199 0.72 GLA (0.31) GAAGLAPOLBTSHR
SCHEMBL395557 0.72 KIF11 (0.39) ALDH1A1
SCHEMBL7657209 0.72 SMN1; SMN2 (0.39) GAAALDH1A1GLAPOLBTSHR
SCHEMBL14302780 0.72 GLA (0.31) GAAGLAPOLBTSHR
SCHEMBL3032982 0.72 CES2 (0.31) GAAGLAPOLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6326517-B1 REACTIN AN AROMATIC COMPOUND WITH CARBON MONOXIDE AND AMMONIA CENTRAL GLASS COMPANY, LIMITED (JP) 2001-12-04 US disclosed
US-6268527-B1 REACTING TRIFLUOROMETHYL SUBSTITUTED AROMATIC COMPOUND WITH CARBON MONOXIDE AND HYDROXY COMPOUND IN PRESENCE OF METAL COMPOUND AND PHOSPHINE DERIVATIVE TO PRODUCE TRIFLUOROMETHYL SUBSTITUTED BENZOIC ACID DERIVATIVE CENTRAL GLASS COMPANY, LIMITED (JP) 2001-07-31 US disclosed