SCHEMBL7556381

SCHEMBL7556381

C=CCOc1ccc2nc(-c3ccc(C=CCCCC(C)F)cc3)ccc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.41
MAOB P27338 2/20 0.39
SRC P12931 2/20 0.36
ABL1 P00519 1/20 0.36
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
KDM4E B2RXH2 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33
CASR P41180 1/20 0.33
MEN1 O00255 1/20 0.33
THRB P10828 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
CA12 O43570 3/20 0.33

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
SCHEMBL7556378 1.00 MAPT (0.41) MAPTMAOBSRCABL1NPC1
SCHEMBL7553246 0.95 MAPT (0.39) MAPTMAOBSRCABL1NPC1
SCHEMBL7553244 0.95 MAPT (0.39) MAPTMAOBSRCABL1NPC1
SCHEMBL8046341 0.90 MAPT (0.45) MAPTMAOBSRCABL1NPC1
SCHEMBL8046333 0.90 MAPT (0.45) MAPTMAOBSRCABL1NPC1
SCHEMBL7552074 0.87 NPC1 (0.41) SRCABL1NPC1RAB9ACASR
SCHEMBL7552072 0.87 NPC1 (0.41) SRCABL1NPC1RAB9ACASR
SCHEMBL7553416 0.87 SRC (0.40) MAPTMAOBSRCABL1NPC1
SCHEMBL7553411 0.87 SRC (0.40) MAPTMAOBSRCABL1NPC1
SCHEMBL8603625 0.86 SRC (0.39) MAOBSRCABL1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708165-B1 Liquid crystal, liquid crystal mixture and liquid crystal device comprising the same SUMITOMO CHEMICAL CO (JP) 2002-01-09 EP disclosed
US-6246452-B1 FERROELECTRIC CHIRAL SMECTIC LIQUID CRYSTAL MIXTURE HAVING IMPROVED RESPONSE SPEED WHICH CAN BE USED AS AN OPTICAL SHUTTER OR DISPLAY DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-06-12 US disclosed
EP-0667384-B1 Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same SUMITOMO CHEMICAL CO (JP) 1998-12-16 EP disclosed
US-5779934-A FLUORINATING AN ALCOHOL DERIVATIVE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-07-14 US disclosed
EP-0708165-A1 Liquid crystal, liquid crystal mixture and liquid crystal device comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-04-24 EP disclosed
EP-0667384-A1 Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-08-16 EP disclosed