SCHEMBL10797441

SCHEMBL10797441

CCN1CCCC1CNC(=O)c1cnc(-c2ccc(OC)cc2)c2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.55
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.52
HSD17B10 Q99714 1/20 0.52
MCHR1 Q99705 2/20 0.51

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
SCHEMBL10798411 0.88 DRD2 (0.58) DRD2KDM4EALDH1A1HPGDHTT
SCHEMBL10780209 0.88 DRD2 (0.49) DRD2KDM4EALDH1A1HPGDHTT
SCHEMBL10802109 0.87 DRD2 (0.49) DRD2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL11073935 0.78 DRD2 (0.48) DRD2KDM4EALDH1A1HPGDHTT
SCHEMBL26114878 0.77 ACHE (0.48) DRD2ALDH1A1HPGDHTT
SCHEMBL10799961 0.76 ADORA2A (0.44)
SCHEMBL10783920 0.76 KDM4E (0.44) DRD2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL11072498 0.76 DRD2 (0.79) DRD2
SCHEMBL13605577 0.75 ROCK2 (0.52) DRD2KDM4EALDH1A1HPGDHTT
SCHEMBL10797290 0.75 ALDH1A1 (0.51) DRD2KDM4EALDH1A1HPGDHSD17B10

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
US-4673682-A ANTIARRYTHMIA AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1987-06-16 US disclosed