SCHEMBL9488457

SCHEMBL9488457

CCCCCCCCCCc1cnc(-c2ccc(OCCCCCC(C)OCC)cc2)nc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.52
NPC1 O15118 5/20 0.52
KDM4E B2RXH2 5/20 0.52
ALDH1A1 P00352 5/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
RARB P10826 4/20 0.50
MAPT P10636 3/20 0.50
HSD17B10 Q99714 3/20 0.50
HPGD P15428 3/20 0.50
MEN1 O00255 2/20 0.50
USP2 O75604 2/20 0.50
KMT2A Q03164 2/20 0.50
GAA P10253 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.47
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
HTT P42858 1/20 0.40
LMNA P02545 2/20 0.40

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
SCHEMBL9488880 1.00 RAB9A (0.52) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL9490681 0.94 RARB (0.54) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL9488401 0.94 RARB (0.54) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL9488868 0.94 RARB (0.54) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL9489189 0.94 RARB (0.54) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL9489359 0.94 RARB (0.54) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL8944908 0.94 RARB (0.54) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL9489010 0.94 RARB (0.54) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL9490239 0.92 RARB (0.54) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL9487948 0.92 RARB (0.54) RAB9ANPC1KDM4EALDH1A1SMN1; 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-0255962-B1 OPTICALLY ACTIVE MESOMORPHIC COMPOUND CANON KABUSHIKI KAISHA (JP) 1993-01-27 EP disclosed
US-5143643-A Liquid crystals CANON KABUSHIKI KAISHA (JP) 1992-09-01 US disclosed
EP-0255962-A2 Optically active mesomorphic compound CANON KABUSHIKI KAISHA (JP) 1988-02-17 EP disclosed