SCHEMBL27518093

SCHEMBL27518093

O=C(NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)N1CCC1=O)[C@@H]1CCCN1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TRHR P34981 1/20 0.43
▸ REN P00797 13/20 0.40
▸ CAPN1 P07384 1/20 0.37
▸ CYP2D6 P10635 1/20 0.36
▸ DPP4 P27487 1/20 0.35

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
SCHEMBL27504185 0.82 TRHR (0.59) TRHRRENCAPN1
SCHEMBL27639586 0.81 TRHR (0.49) TRHRRENCAPN1
SCHEMBL27448784 0.81 TRHR (0.49) TRHRRENCAPN1
SCHEMBL21219553 0.81 REN (0.42) TRHRRENCAPN1
SCHEMBL21219550 0.80 TRHR (0.43) TRHRRENCAPN1
SCHEMBL27772271 0.78 REN (0.38) TRHRRENCAPN1
SCHEMBL27273945 0.77 CYP3A4 (0.50) RENDPP4
SCHEMBL27502009 0.77 REN (0.42) TRHRRENCAPN1
SCHEMBL31339185 0.75 EPHX2 (0.51) TRHRRENCAPN1
SCHEMBL29792521 0.75 EPHX2 (0.51) TRHRRENCAPN1

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
CN-1282262-A Layered rate controlling membranes for use in electrotransport device ALZA CORP (US) 2001-01-31 — — CN disclosed
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