SCHEMBL28860184

SCHEMBL28860184

C[C](C)CN1CCN(c2ccnc(Cl)n2)CC1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SORD Q00796 8/20 0.50
TRPV1 Q8NER1 10/20 0.48
OGA O60502 1/20 0.44

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
SCHEMBL15260204 0.83 HRH3 (0.51) SORDTRPV1OGA
SCHEMBL20361177 0.81 SORD (0.55) SORDTRPV1
SCHEMBL23582278 0.80 TRPV1 (0.47) SORDTRPV1
SCHEMBL15260059 0.80 MAP4K4 (0.53) SORDTRPV1OGA
SCHEMBL29997962 0.78 HRH4 (0.65) SORDTRPV1
SCHEMBL2190955 0.78 HRH4 (0.65) SORDTRPV1
SCHEMBL21193615 0.78 TRPV1 (0.62) SORDTRPV1
SCHEMBL3960913 0.77 HRH3 (0.65) SORD
SCHEMBL3949154 0.76 TRPV1 (0.51) SORDTRPV1OGA
SCHEMBL29519276 0.76 TRPV1 (0.51) SORDTRPV1OGA

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-108135175-A Bicyclic compounds and their use for inhibition of SUV39H2 肿瘤疗法科学股份有限公司 2018-06-08 CN disclosed