SCHEMBL27910345

SCHEMBL27910345

C=Cc1ccc2c(c1)c1cc(C=C)ccc1n2CCCC

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RORA P35398 6/20 0.44
RORC P51449 6/20 0.44
RORB Q92753 6/20 0.44
PGR P06401 5/20 0.44
PSEN1 P49768 1/20 0.42
PSEN2 P49810 1/20 0.42
APH1B Q8WW43 1/20 0.42
NCSTN Q92542 1/20 0.42
APH1A Q96BI3 1/20 0.42
PSENEN Q9NZ42 1/20 0.42
PTGER4 P35408 2/20 0.41
CNR2 P34972 5/20 0.41
ALDH1A1 P00352 1/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL27880231 0.94 PSEN1 (0.49) RORARORCRORBPSEN1PSEN2
SCHEMBL27888231 0.94 PSEN1 (0.49) RORARORCRORBPSEN1PSEN2
SCHEMBL15209181 0.94 PSEN1 (0.49) RORARORCRORBPSEN1PSEN2
SCHEMBL11786017 0.93 PGR (0.52) RORARORCRORBPGRPTGER4
SCHEMBL11783888 0.88 CNR2 (0.56) RORARORCRORBPGRPSEN1
SCHEMBL2329107 0.87 CNR2 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL28449880 0.87 CNR2 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL11780466 0.87 CNR2 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL11782197 0.87 CNR2 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL27997616 0.87 PSEN1 (0.42) RORARORCRORBPGRPSEN1

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-103159929-A Difluoro-benzotriazole based co-polymer solar cell material, and preparation method and application thereof OCEANS KING LIGHTING SCIENCE 2013-06-19 CN disclosed