SCHEMBL12593265

SCHEMBL12593265

CCCCCC1(CCCCC)Oc2cc(C)ccc2-c2ccc(C)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.44
CNR1 P21554 14/20 0.44
TRPA1 O75762 2/20 0.38
TRPV1 Q8NER1 2/20 0.38
TRPV3 Q8NET8 2/20 0.38
TRPV4 Q9HBA0 2/20 0.38
TRPV2 Q9Y5S1 2/20 0.38
CYP1A1 P04798 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
CYP2B6 P20813 1/20 0.38
SLC6A2 P23975 1/20 0.38
HTR2A P28223 1/20 0.38
SLC6A4 P31645 1/20 0.38
OPRM1 P35372 1/20 0.38
CYP2J2 P51589 1/20 0.38
CYP1B1 Q16678 1/20 0.38
PPARG P37231 1/20 0.35
PDK2 Q15119 1/20 0.31
TLR8 Q9NR97 1/20 0.30

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
SCHEMBL12611467 0.99 CNR1 (0.46) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL11928953 0.99 CNR1 (0.46) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL12982292 0.81 CNR1 (0.39) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL13196590 0.81 CNR1 (0.37) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL14282521 0.81 CNR1 (0.39) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL862322 0.80 CNR1 (0.36) CNR2CNR1CYP1A2PDK2NPC1
SCHEMBL12611434 0.79 CNR1 (0.32) CNR2CNR1PDK2
SCHEMBL11980523 0.79 CNR1 (0.36) CNR2CNR1
SCHEMBL13196579 0.79 CNR1 (0.36) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL12611421 0.79 CNR1 (0.38) CNR2CNR1TRPA1TRPV1TRPV3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110121278-A1 SOLUTION COMPOSITION AND POLYMER LIGHT-EMITTING DEVICE SUMITOMO CHEMICAL CO., LTD. (JP) 2011-05-26 US disclosed
US-7910025-B2 Solution composition and polymer light-emitting device SUMITOMO CHEMICAL CO., LTD. (JP) 2011-03-22 US disclosed
US-20080061673-A1 Solution Composition And Polymer Light-Emitting Device SUMITOMO CHEMICAL CO., LTD. (JP) 2008-03-13 US disclosed