SCHEMBL7561558

SCHEMBL7561558

C=CCc1ccc(-c2ccc(-c3ccc(CCCCCC(C)F)cc3)cc2)nc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.47
SMN1; SMN2 Q16637 10/20 0.47
NPC1 O15118 8/20 0.47
MAPT P10636 4/20 0.47
STAT3 P40763 1/20 0.47
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.43
CASP3 P42574 2/20 0.43
SENP8 Q96LD8 2/20 0.43
SENP7 Q9BQF6 2/20 0.43
SENP6 Q9GZR1 2/20 0.43
NFKB1 P19838 2/20 0.43
NFKB2 Q00653 2/20 0.43
RELA Q04206 2/20 0.43
MAPK1 P28482 1/20 0.43
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 4/20 0.41
HPGD P15428 4/20 0.41
TP53 P04637 2/20 0.36
MITF O75030 1/20 0.36

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
SCHEMBL7558886 0.99 RAB9A (0.48) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL7555580 0.96 SMN1; SMN2 (0.48) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL7559458 0.95 SMN1; SMN2 (0.49) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL7559531 0.94 RAB9A (0.43) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL7556534 0.94 RAB9A (0.43) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL8597872 0.90 SMN1; SMN2 (0.40) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL7554359 0.87 RAB9A (0.44) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL7556629 0.86 RAB9A (0.36) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL8596925 0.86 RAB9A (0.41) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL7943922 0.86 RAB9A (0.51) RAB9ASMN1; SMN2NPC1MAPTSTAT3

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 5 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
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