SCHEMBL31060428

SCHEMBL31060428

COc1ccc(C2CC(=O)c3ccc(F)cc3O2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 19/20 1.00
CYP19A1 P11511 3/20 0.81
CYP3A4 P08684 1/20 0.81
NPC1 O15118 1/20 0.68
MAPT P10636 1/20 0.68
RAB9A P51151 1/20 0.68

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
SCHEMBL30674787 0.92 MAOB (1.00) MAOBCYP19A1CYP3A4
Liquiritigenin Dimethyl Ether SCHEMBL3303937 0.89 CYP19A1 (1.00) MAOBCYP19A1CYP3A4NPC1MAPT
Liquiritigenin Dimethyl Ether SCHEMBL13394438 0.89 CYP19A1 (1.00) MAOBCYP19A1CYP3A4NPC1MAPT
SCHEMBL11242835 0.85 MAOB (0.81) MAOBCYP19A1CYP3A4NPC1MAPT
SCHEMBL7195893 0.85 CYP19A1 (0.86) MAOBCYP19A1CYP3A4NPC1MAPT
SCHEMBL18893710 0.85 MAOB (0.81) MAOBCYP19A1CYP3A4NPC1MAPT
SCHEMBL30777574 0.85 MAOB (0.81) MAOBCYP19A1CYP3A4NPC1MAPT
SCHEMBL31028354 0.85 CYP19A1 (0.86) MAOBCYP19A1CYP3A4NPC1MAPT
SCHEMBL10360819 0.84 MAOB (1.00) MAOBCYP19A1
SCHEMBL10360962 0.84 MAOB (1.00) MAOBCYP19A1

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-4662319-A2 PERSONALIZED CRISPR PROFILING FOR CANCER Integrate Bioscience LLC (US) 2025-12-17 EP disclosed
WO-2024168301-A2 PERSONALIZED CRISPR PROFILING FOR CANCER FUNCTION ONCOLOGY, INC. (US) 2024-08-15 WO disclosed