SCHEMBL7659507

SCHEMBL7659507

OCC(O)C(CO)NCc1cccc(CNC(CO)C(O)CO)n1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TRPV3 Q8NET8 17/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.41
▸ PNP P00491 1/20 0.39

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
SCHEMBL7108751 0.82 PNP (0.39) TRPV3PNP
SCHEMBL7103658 0.78 PNP (0.43) TRPV3PNP
SCHEMBL7662208 0.77 TRPV3 (0.46) TRPV3NPSR1
SCHEMBL7650049 0.75 TRPV3 (0.43) TRPV3NPSR1PNP
SCHEMBL7652028 0.73 PNP (0.39) TRPV3PNP
SCHEMBL12538333 0.72 TRPV3 (0.64) TRPV3
SCHEMBL5343914 0.72 TRPV3 (0.64) TRPV3
SCHEMBL7071084 0.71 PNP (0.39) TRPV3PNP
SCHEMBL7075461 0.71 PNP (0.39) TRPV3PNP
SCHEMBL7072329 0.71 PNP (0.39) TRPV3PNP

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-6399613-B1 N,N'-BIS(2-HYDROXYETHYL)PYRAZINE-2,5- OR -2,6-DICARBOXAMIDE; DIABETES AVENTIS PHARMA S.A. (FR) 2002-06-04 — — US claimed
US-6399613-B1 N,N'-BIS(2-HYDROXYETHYL)PYRAZINE-2,5- OR -2,6-DICARBOXAMIDE; DIABETES AVENTIS PHARMA S.A. (FR) 2002-06-04 — — US disclosed
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