SCHEMBL13286181

SCHEMBL13286181

CCCCn1c(-c2ccc[nH]2)c(C2CCCCC2)c2ccc(COOC)cc21

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.32

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
SCHEMBL804640 0.92 HDAC1 (0.31)
SCHEMBL13286184 0.76 CNR2 (0.33) CNR2
SCHEMBL14263519 0.74 ACP1 (0.33) CNR2
SCHEMBL773870 0.74 SCN9A (0.39) CNR2
SCHEMBL13285756 0.73 TP53 (0.36) CNR2
SCHEMBL804620 0.73 TP53 (0.36) CNR2
SCHEMBL803857 0.72 ESR1 (0.34)
SCHEMBL13286268 0.71 TP53 (0.35) CNR2
SCHEMBL14263695 0.70 HDAC1 (0.32)
SCHEMBL13886661 0.70 HDAC1 (0.33)

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-2206715-A1 Fused heterotetracyclic compounds and use thereof as hcv polymerase inhibitor Japan Tobacco, Inc. (JP) 2010-07-14 EP disclosed