SCHEMBL8634550

SCHEMBL8634550

Cc1ccc(Nc2ccc3c(c2)CCCC3)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.62
NPC1 O15118 5/20 0.58
RAB9A P51151 5/20 0.58
POLB P06746 2/20 0.58
ALDH1A1 P00352 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
LMNA P02545 3/20 0.55
MAPT P10636 3/20 0.55
NFKB1 P19838 2/20 0.55
NFKB2 Q00653 2/20 0.55
RELA Q04206 2/20 0.55
DPP4 P27487 1/20 0.55
THRB P10828 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ADRA2A P08913 2/20 0.49
ADRA2B P18089 1/20 0.49
ADRA2C P18825 1/20 0.49
CCNA2 P20248 1/20 0.47

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
SCHEMBL1673420 0.96 RAPGEF4 (0.67) RAPGEF4NPC1RAB9APOLBALDH1A1
SCHEMBL12367736 0.92 RAPGEF4 (0.56) RAPGEF4NPC1RAB9APOLBALDH1A1
SCHEMBL25912039 0.88 RAPGEF4 (0.58) RAPGEF4NPC1RAB9APOLBALDH1A1
SCHEMBL379238 0.83 RAPGEF4 (0.63) RAPGEF4NPC1RAB9APOLBALDH1A1
SCHEMBL14981731 0.83 POLB (0.64) RAPGEF4NPC1RAB9APOLBALDH1A1
SCHEMBL8386481 0.82 NPC1 (0.57) RAPGEF4NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL3476199 0.81 EGFR (0.52) RAPGEF4NPC1RAB9AALDH1A1MAPT
SCHEMBL18583900 0.79 RAPGEF4 (0.52) RAPGEF4NPC1RAB9APOLBALDH1A1
SCHEMBL13174486 0.78 APP (0.51) RAPGEF4NPC1RAB9APOLBALDH1A1
SCHEMBL12377130 0.78 NPC1 (0.62) RAPGEF4NPC1RAB9AALDH1A1SMN1; SMN2

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-5840980-A CHARGE TRANSPORT COMPOUNDS; PHOTORECEPTORS WITH HIGH SENSITIVITY AND DURABILITY HODOGAYA CHEMICAL CO., LTD. (JP) 1998-11-24 US disclosed
US-5707768-A ELECTROCONDUCTIVE SUBSTRATE HAVING A PHOTOSENSITIVE LAYER CONTAINING A BINDER RESIN, A CHARGE GENERATING MATERIAL OR A SENSITIZING DYE AND A DIAMINE COMPOUND THEREON HODOGAYA CHEMICAL CO., LTD. (JP) 1998-01-13 US disclosed