SCHEMBL26736359

SCHEMBL26736359

O=CC(CNc1nnc(N2CCC(COc3nnc(NC(=O)Cc4ccccc4)s3)CC2)s1)c1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GLS O94925 20/20 0.77

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
SCHEMBL17654152 0.88 GLS (1.00) GLS
SCHEMBL21077454 0.85 GLS (0.75) GLS
SCHEMBL17654117 0.83 GLS (1.00) GLS
SCHEMBL17654085 0.83 GLS (1.00) GLS
SCHEMBL17654128 0.79 GLS (0.85) GLS
SCHEMBL17654103 0.78 GLS (1.00) GLS
SCHEMBL17664625 0.75 GLS (1.00) GLS
SCHEMBL19434577 0.75 GLS (1.00) GLS
SCHEMBL17654090 0.75 GLS (1.00) GLS
SCHEMBL17654165 0.73 GLS (1.00) GLS

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
WO-2023215756-A2 COMPOSITIONS AND METHODS FOR TREATING PULMONARY VASCULAR DISEASE UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2023-11-09 — — WO disclosed
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