SCHEMBL11557147

SCHEMBL11557147

O=C(O)C1Cc2sccc2CN1Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 1/20 0.53
▸ GRM6 O15303 1/20 0.44
▸ CYP19A1 P11511 1/20 0.44

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
SCHEMBL11559591 0.86 CYP1A2 (0.51) ACECYP19A1
SCHEMBL11427641 0.85 ACE (0.42) ACECYP19A1
Hydrochloric Acid SCHEMBL11560085 0.84 ACE (0.41) ACECYP19A1
SCHEMBL29870443 0.81 ACE (0.49) ACEGRM6CYP19A1
SCHEMBL8336724 0.81 ACE (0.49) ACEGRM6CYP19A1
SCHEMBL7478005 0.81 ACE (0.49) ACEGRM6CYP19A1
SCHEMBL11558268 0.81 ACE (0.46) ACE
SCHEMBL11562644 0.81 CYP19A1 (0.42) ACEGRM6CYP19A1
SCHEMBL8044487 0.77 GRM6 (0.50) ACEGRM6CYP19A1
SCHEMBL27245241 0.77 GRM6 (0.50) ACEGRM6CYP19A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4147787-A ANTICOAGULANTS PARCOR (FR) 1979-04-03 — — US disclosed
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