SCHEMBL31346009

SCHEMBL31346009

FC(F)(F)c1ccc2c(c1)CC(c1cccc(-c3nnn[nH]3)c1)O2

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.37
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
HRH1 P35367 1/20 0.32
HRH4 Q9H3N8 1/20 0.32
SCN2A Q99250 1/20 0.32
NOTUM Q6P988 1/20 0.31
HTR2C P28335 1/20 0.30
SCN9A Q15858 1/20 0.30
KDM1A O60341 1/20 0.30
MAOB P27338 1/20 0.30
CYP19A1 P11511 1/20 0.30
KIF11 P52732 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
SCHEMBL31345965 1.00 FFAR1 (0.37) FFAR1HTR1ATEAD1CASP3CASP7
SCHEMBL31346007 0.92 HTR1A (0.34) FFAR1HTR1ATEAD1CASP3CASP7
SCHEMBL31346061 0.87 CYP11B1 (0.35)
SCHEMBL31346127 0.87
SCHEMBL31346024 0.86 TERT (0.33) FFAR1
SCHEMBL31346167 0.84 CASP3 (0.32) CASP3CASP7CASP8
SCHEMBL31346111 0.83 FFAR1 (0.37) FFAR1NOTUMCYP19A1
SCHEMBL31346138 0.83 FFAR1 (0.35) FFAR1KDM1AMAOBCYP19A1
SCHEMBL31346044 0.83 MRGPRX4 (0.31) HTR1ATEAD1
SCHEMBL31346062 0.83 FFAR1 (0.35) FFAR1MAOBCYP19A1

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