SCHEMBL6523214

SCHEMBL6523214

[CH]1CCCC(CCCC2CC[CH]CCC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.41
SIGMAR1 Q99720 4/20 0.38
CEL P19835 2/20 0.33
SLC18A3 Q16572 1/20 0.31
EPHX1 P07099 1/20 0.31

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
SCHEMBL6523071 0.90 CYP1A2 (0.46) CYP1A2SIGMAR1CELSLC18A3EPHX1
SCHEMBL6523445 0.90 CYP1A2 (0.33) CYP1A2SIGMAR1
SCHEMBL144946 0.87 CYP1A2 (0.61) CYP1A2SIGMAR1
SCHEMBL6518515 0.85 CYP1A2 (0.52) CYP1A2SIGMAR1CELSLC18A3EPHX1
SCHEMBL6523849 0.85 CYP1A2 (0.52) CYP1A2SIGMAR1CELSLC18A3EPHX1
SCHEMBL6522113 0.85 CYP1A2 (0.52) CYP1A2SIGMAR1CELSLC18A3EPHX1
SCHEMBL6525950 0.85 CYP1A2 (0.52) CYP1A2SIGMAR1CELSLC18A3EPHX1
SCHEMBL4358424 0.85 CYP1A2 (0.52) CYP1A2SIGMAR1CELSLC18A3EPHX1
SCHEMBL3031906 0.85 CYP1A2 (0.54) CYP1A2SIGMAR1EPHX1
SCHEMBL455412 0.83 CYP1A2 (0.52) CYP1A2SIGMAR1EPHX1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8487071-B2 Polyether polymer and production process thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-16 US disclosed
US-20110065889-A1 POLYETHER POLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-17 US disclosed