SCHEMBL7559524

SCHEMBL7559524

C=CCc1ccc2cc(-c3ccc(C=CCCCC(C)F)cc3)ncc2c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.36
RAB9A P51151 5/20 0.36
CASP3 P42574 2/20 0.36
SENP7 Q9BQF6 2/20 0.36
KDM4E B2RXH2 3/20 0.31
ALDH1A1 P00352 3/20 0.31
HPGD P15428 3/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
MITF O75030 1/20 0.31
KLF5 Q13887 1/20 0.31

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
SCHEMBL7559517 1.00 NPC1 (0.36) NPC1RAB9ACASP3SENP7KDM4E
SCHEMBL7554784 0.94 NPC1 (0.36) NPC1RAB9ACASP3SENP7
SCHEMBL7554787 0.94 NPC1 (0.36) NPC1RAB9ACASP3SENP7
SCHEMBL8046480 0.90 NPC1 (0.36) NPC1RAB9ACASP3SENP7KDM4E
SCHEMBL8046482 0.90 NPC1 (0.36) NPC1RAB9ACASP3SENP7KDM4E
SCHEMBL8602711 0.89 NPC1 (0.33) NPC1RAB9ACASP3SENP7KDM4E
SCHEMBL8602712 0.89 NPC1 (0.33) NPC1RAB9ACASP3SENP7KDM4E
SCHEMBL7557685 0.87 PTGS2 (0.35) ALDH1A1
SCHEMBL7559386 0.87 KDM4E (0.35) NPC1RAB9ACASP3SENP7KDM4E
SCHEMBL7559382 0.87 KDM4E (0.35) NPC1RAB9ACASP3SENP7KDM4E

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