SCHEMBL8564925

SCHEMBL8564925

CC(CCCCCc1ccc(-c2ncc(O)cn2)cc1)OC1CCCCO1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MGLL Q99685 2/20 0.35
RARB P10826 1/20 0.33
SPHK2 Q9NRA0 7/20 0.32
SPHK1 Q9NYA1 5/20 0.32
KDM4C Q9H3R0 1/20 0.32
NPC1 O15118 2/20 0.32
STAT3 P40763 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL8602508 0.85 MEN1 (0.33) RAB9AMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL8670843 0.83 KDM4E (0.40) RAB9AMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL8668775 0.78 MEN1 (0.34) RAB9AMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL8566480 0.76 SPHK2 (0.31) SPHK2SPHK1
SCHEMBL8443397 0.75 RAB9A (0.51) RAB9AMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL27147707 0.73 FKBP1A (0.37) MAPTKDM4EGAAHSD17B10MGLL
SCHEMBL27131627 0.73 FKBP1A (0.37) MAPTKDM4EGAAHSD17B10MGLL
SCHEMBL8444589 0.72 RARB (0.44) RAB9AMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL8569516 0.72 FDFT1 (0.33) MEN1KMT2AKDM4C
SCHEMBL9424628 0.71 MEN1 (0.33) RAB9AMEN1KMT2AMAPTSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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