SCHEMBL11228030

SCHEMBL11228030

O=C1c2cc(O)cc(Br)c2OCC1n1ccnc1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.34

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
Hydrochloric Acid SCHEMBL11230929 0.99 CYP19A1 (0.34) CYP19A1
SCHEMBL11226736 0.88 TERT (0.33) CYP19A1
Hydrochloric Acid SCHEMBL11237126 0.87 TERT (0.33) CYP19A1
SCHEMBL11235842 0.86 CYP19A1 (0.34) CYP19A1
SCHEMBL11228488 0.86 MEN1 (0.34) CYP19A1
SCHEMBL11221326 0.86
SCHEMBL11227382 0.85 TBXAS1 (0.32) CYP19A1
SCHEMBL11236308 0.85 CYP19A1 (0.34) CYP19A1
Hydrochloric Acid SCHEMBL11236690 0.85 MEN1 (0.33)
Hydrochloric Acid SCHEMBL11242068 0.84 TBXAS1 (0.31) 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
US-4342775-A FOR USE AS ANTICOAGULANT AND REDUCING SERUM SHOLESTEROL OR SERUM TRIGLYCERIDES FARMITALIA CARLO ERBA S.P.A. (IT) 1982-08-03 US claimed
US-4342775-A FOR USE AS ANTICOAGULANT AND REDUCING SERUM SHOLESTEROL OR SERUM TRIGLYCERIDES FARMITALIA CARLO ERBA S.P.A. (IT) 1982-08-03 US disclosed