SCHEMBL31345982

SCHEMBL31345982

O=C(O)c1cccc(C2Cc3cc(-c4ccc(F)cc4)ccc3O2)c1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
FFAR1 O14842 2/20 0.44
MAOB P27338 8/20 0.43
TDP1 Q9NUW8 1/20 0.43
CFTR P13569 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.41
AR P10275 1/20 0.41
BCL2L1 Q07817 1/20 0.40
BAD Q92934 1/20 0.40
KMO O15229 2/20 0.39

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
SCHEMBL31346085 0.83 ALDH1A1 (0.42) ALDH1A1FFAR1TDP1CFTRAR
SCHEMBL31346183 0.82 KMO (0.56) ALDH1A1FFAR1TDP1KMO
SCHEMBL31346172 0.81 ALDH1A1 (0.48) ALDH1A1FFAR1TDP1ARKMO
SCHEMBL31346099 0.80 CFTR (0.49) ALDH1A1FFAR1TDP1CFTRMRGPRX4
SCHEMBL31345978 0.80 CFTR (0.49) ALDH1A1FFAR1TDP1CFTRMRGPRX4
SCHEMBL31345983 0.78 ALDH1A1 (0.45) ALDH1A1FFAR1MAOBTDP1CFTR
SCHEMBL31346163 0.78 TDP1 (0.47) ALDH1A1FFAR1MAOBTDP1MRGPRX4
SCHEMBL31346052 0.78 TDP1 (0.47) ALDH1A1FFAR1TDP1CFTRMRGPRX4
SCHEMBL31346166 0.77 MRGPRX4 (0.45) ALDH1A1FFAR1TDP1CFTRMRGPRX4
SCHEMBL31346154 0.77 ALDH1A1 (0.49) ALDH1A1FFAR1MAOBTDP1MRGPRX4

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