SCHEMBL8568388

SCHEMBL8568388

CCCCCCCCCCOc1cnc(-c2ccc(CCCCCC(C)F)cc2)nc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.55
MAPT P10636 5/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
MEN1 O00255 3/20 0.55
ALDH1A1 P00352 3/20 0.55
KMT2A Q03164 3/20 0.55
KDM4E B2RXH2 2/20 0.55
HSD17B10 Q99714 2/20 0.55
USP2 O75604 2/20 0.55
GAA P10253 1/20 0.55
HPGD P15428 1/20 0.55
RARB P10826 5/20 0.46
NPC1 O15118 4/20 0.45
PLA2G4A P47712 1/20 0.43
LMNA P02545 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP1 P29466 1/20 0.41
SLCO1B3 Q9NPD5 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41

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
SCHEMBL8569401 0.96 RAB9A (0.53) RAB9AMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL10469637 0.89 RAB9A (0.68) RAB9AMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL9636046 0.89 RAB9A (0.68) RAB9AMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL9636358 0.89 RAB9A (0.68) RAB9AMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL9636385 0.89 RAB9A (0.68) RAB9AMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL9637685 0.89 RAB9A (0.68) RAB9AMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL10469584 0.89 RAB9A (0.68) RAB9AMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL9637550 0.89 RAB9A (0.68) RAB9AMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL9637589 0.89 RAB9A (0.68) RAB9AMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL9635847 0.89 RAB9A (0.68) RAB9AMAPTSMN1; SMN2MEN1ALDH1A1

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
US-5779934-A FLUORINATING AN ALCOHOL DERIVATIVE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-07-14 US claimed
JP-7267885-A None JP 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
JP-H07267885-A COMPOUND HAVING FLUORINE ATOM, ITS PRODUCTION AND USE SUMITOMO CHEM CO LTD 1995-10-17 JP 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