SCHEMBL4427423

SCHEMBL4427423

CN1CCCc2ccc(NC(=O)c3cccc(-c4ccc(C(N)=O)cc4)c3)cc21

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 15/20 0.62
TRPV1 Q8NER1 2/20 0.58
PLAU P00749 1/20 0.50
PLAT P00750 1/20 0.50
OGG1 O15527 1/20 0.50

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
SCHEMBL13863830 0.96 CREBBP (0.60) CREBBPTRPV1PLAUPLATOGG1
SCHEMBL4429044 0.92 CREBBP (0.60) CREBBPTRPV1
SCHEMBL4426859 0.90 CREBBP (0.62) CREBBPTRPV1
SCHEMBL4434512 0.86 CREBBP (0.73) CREBBPTRPV1
SCHEMBL13865652 0.85 CREBBP (0.60) CREBBPTRPV1
SCHEMBL4427826 0.83 CREBBP (0.64) CREBBPTRPV1
SCHEMBL4422899 0.82 CREBBP (0.67) CREBBPTRPV1
SCHEMBL4424245 0.82 CREBBP (0.61) CREBBPTRPV1
SCHEMBL13998316 0.81 TRPV1 (0.64) CREBBPTRPV1
SCHEMBL4428957 0.81 CREBBP (0.58) CREBBPTRPV1OGG1

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
EP-2033953-A1 Vanilloid receptor modulators Glaxo Group Limited (GB) 2009-03-11 EP disclosed