SCHEMBL7554909

SCHEMBL7554909

C=CCOc1ccc(-c2ccc(C#CCCCC(C)F)cn2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38
HPGD P15428 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
HTT P42858 1/20 0.38
CYP2D6 P10635 2/20 0.35
MCHR1 Q99705 1/20 0.34
MAPT P10636 2/20 0.33
GRM5 P41594 1/20 0.33
RAB9A P51151 1/20 0.33
MAPK1 P28482 1/20 0.32
SRC P12931 2/20 0.31
ABL1 P00519 1/20 0.31
CASP3 P42574 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
DCTPP1 Q9H773 1/20 0.31
SIRT1 Q96EB6 1/20 0.30
CHRNB2 P17787 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
SCHEMBL7557875 0.99 KDM4E (0.38) ALDH1A1KDM4EHPGDL3MBTL1HTT
SCHEMBL7554874 0.95 KDM4E (0.35) ALDH1A1KDM4EHPGDL3MBTL1HTT
SCHEMBL7557233 0.94 KDM4E (0.35) ALDH1A1KDM4EHPGDL3MBTL1HTT
SCHEMBL7554200 0.94 KDM4E (0.35) ALDH1A1KDM4EHPGDL3MBTL1HTT
SCHEMBL7553635 0.94 KDM4E (0.35) ALDH1A1KDM4EHPGDL3MBTL1HTT
SCHEMBL7554215 0.93 CYP2D6 (0.36) ALDH1A1KDM4EHPGDL3MBTL1HTT
SCHEMBL8600121 0.92 SRC (0.39) ALDH1A1KDM4EHPGDL3MBTL1HTT
SCHEMBL7554326 0.90 CYP2D6 (0.36) ALDH1A1KDM4EHPGDL3MBTL1HTT
SCHEMBL7561123 0.88 CYP2D6 (0.40) ALDH1A1KDM4ECYP2D6MAPTRAB9A
SCHEMBL8604072 0.88 CYP2D6 (0.40) ALDH1A1KDM4ECYP2D6MAPTRAB9A

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