SCHEMBL31415772

SCHEMBL31415772

Fc1ccc(CCn2cc(Cn3ccnc3)nn2)cc1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 4/20 0.57
▸ CYP11B1 P15538 3/20 0.57
▸ CYP11B2 P19099 3/20 0.57
▸ MAPK1 P28482 1/20 0.47
▸ TBXAS1 P24557 1/20 0.43

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
SCHEMBL31415761 0.88 CYP19A1 (0.58) CYP19A1CYP11B1CYP11B2TBXAS1
SCHEMBL31415791 0.88 CYP11B1 (0.57) CYP19A1CYP11B1CYP11B2TBXAS1
SCHEMBL31415760 0.88 CYP11B1 (0.57) CYP19A1CYP11B1CYP11B2TBXAS1
SCHEMBL31415764 0.87 CYP11B1 (0.55) CYP19A1CYP11B1CYP11B2TBXAS1
SCHEMBL31415832 0.87 HMOX1 (0.54) CYP19A1CYP11B1CYP11B2TBXAS1
SCHEMBL31415757 0.82 CYP1A2 (0.47) CYP19A1CYP11B1CYP11B2
SCHEMBL31415786 0.81 CYP19A1 (0.56) CYP19A1CYP11B1CYP11B2TBXAS1
SCHEMBL31415789 0.80 CYP11B1 (0.52) CYP19A1CYP11B1CYP11B2TBXAS1
SCHEMBL31415749 0.79 CYP11B1 (0.51) CYP19A1CYP11B1CYP11B2TBXAS1
SCHEMBL31415750 0.79 LMNA (0.43) CYP19A1

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
WO-2025003984-A1 INHIBITORS OF HEME OXYGENASE, COMPOSITIONS AND USES THEREOF Università Degli Studi del Piemonte Orientale “Amedeo Avogadro” (IT) 2025-01-02 — — WO claimed
WO-2025003984-A1 INHIBITORS OF HEME OXYGENASE, COMPOSITIONS AND USES THEREOF Università Degli Studi del Piemonte Orientale “Amedeo Avogadro” (IT) 2025-01-02 — — WO disclosed
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