SCHEMBL6367697

SCHEMBL6367697

CCCCCCc1cc(-c2ncc[nH]2)c(C)cc1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 2/20 0.43
MTOR P42345 1/20 0.43
ADK P55263 1/20 0.43
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP19A1 P11511 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
RARB P10826 1/20 0.39
SOAT1 P35610 1/20 0.38
PSMB5 P28074 1/20 0.37
ADORA3 P0DMS8 1/20 0.35
ADORA2A P29274 1/20 0.35
VCP P55072 1/20 0.35
SMO Q99835 1/20 0.35
TLR8 Q9NR97 1/20 0.35
HSD11B1 P28845 1/20 0.35
GCGR P47871 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
SCHEMBL6367427 0.92 NISCH (0.42) NISCHMTORADKCYP1A2CYP3A4
SCHEMBL10414554 0.79 CYP1A2 (0.46) NISCHMTORADKCYP1A2CYP3A4
SCHEMBL15809922 0.78 CYP1A2 (0.47) NISCHMTORADKCYP1A2CYP3A4
SCHEMBL31419337 0.78 CYP1A2 (0.47) NISCHMTORADKCYP1A2CYP3A4
SCHEMBL25867877 0.76 LIPG (0.47) MTORRARBSOAT1TLR8HSD11B1
2-Phenylimidazole SCHEMBL27311182 0.75 NISCH (0.58) NISCHMTORADKCYP1A2CYP3A4
2-Phenylimidazole SCHEMBL9066421 0.75 NISCH (0.58) NISCHMTORADKCYP1A2CYP3A4
2-Phenylimidazole SCHEMBL8735470 0.75 NISCH (0.58) NISCHMTORADKCYP1A2CYP3A4
SCHEMBL8538742 0.74 CYP1A2 (0.48) NISCHMTORADKCYP1A2CYP3A4
SCHEMBL24608921 0.73 LIPG (0.45) MTORRARBSOAT1TLR8HSD11B1

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-20050173678-A1 Surface treatment agents for metal films of printed circuit boards TAMURA KAKEN CORPORATION (JP) 2005-08-11 US disclosed