SCHEMBL31346007

SCHEMBL31346007

FC(F)(F)c1ccc2c(c1)OC(c1cccc(-c3nnn[nH]3)c1)C2

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.34
TEAD1 P28347 1/20 0.33
CASP3 P42574 1/20 0.32
CASP7 P55210 1/20 0.32
CASP8 Q14790 1/20 0.32
SCN2A Q99250 1/20 0.32
FFAR1 O14842 4/20 0.32
CTSD P07339 1/20 0.31
BRD4 O60885 1/20 0.31
NOTUM Q6P988 1/20 0.31
HTR2C P28335 2/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30
ASIC3 Q9UHC3 1/20 0.30
KIF11 P52732 1/20 0.30
PNMT P11086 1/20 0.30

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
SCHEMBL31346009 0.92 FFAR1 (0.37) HTR1ATEAD1CASP3CASP7CASP8
SCHEMBL31345965 0.92 FFAR1 (0.37) HTR1ATEAD1CASP3CASP7CASP8
SCHEMBL31346062 0.83 FFAR1 (0.35) FFAR1
SCHEMBL31346044 0.81 MRGPRX4 (0.31) HTR1ATEAD1
SCHEMBL31345964 0.81 FFAR1 (0.37) FFAR1
SCHEMBL31346024 0.80 TERT (0.33) FFAR1
SCHEMBL31346012 0.79 FFAR1 (0.35) FFAR1
SCHEMBL31346050 0.79 FFAR1 (0.39) FFAR1
SCHEMBL31346000 0.79 FFAR1 (0.35) FFAR1
SCHEMBL31346061 0.78 CYP11B1 (0.35)

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
EP-4712967-A2 G-PROTEIN COUPLED RECEPTOR ANTAGONIST Enveda Therapeutics, Inc. (US) 2026-03-25 EP disclosed
WO-2024239000-A2 G-PROTEIN COUPLED RECEPTOR ANTAGONIST ENVEDA THERAPEUTICS, INC. (US) 2024-11-21 WO disclosed