SCHEMBL9487948

SCHEMBL9487948

CCCCCCCCCc1cnc(-c2ccc(OCCCC(C)OCCCCC)cc2)nc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.54
RAB9A P51151 5/20 0.53
KDM4E B2RXH2 4/20 0.53
NPC1 O15118 3/20 0.53
SMN1; SMN2 Q16637 4/20 0.51
MAPT P10636 4/20 0.51
ALDH1A1 P00352 4/20 0.51
HPGD P15428 3/20 0.51
HSD17B10 Q99714 2/20 0.51
MEN1 O00255 2/20 0.51
USP2 O75604 2/20 0.51
KMT2A Q03164 2/20 0.51
GAA P10253 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.45
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL9490239 1.00 RARB (0.54) RARBRAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL9490681 0.98 RARB (0.54) RARBRAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL9488401 0.98 RARB (0.54) RARBRAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL9489010 0.98 RARB (0.54) RARBRAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL9489189 0.98 RARB (0.54) RARBRAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL8944908 0.98 RARB (0.54) RARBRAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL9488868 0.98 RARB (0.54) RARBRAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL9489359 0.98 RARB (0.54) RARBRAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL9490463 0.95 RAB9A (0.53) RARBRAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL9487339 0.95 RARB (0.54) RARBRAB9AKDM4ENPC1SMN1; 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 2 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
EP-0255962-A2 Optically active mesomorphic compound CANON KABUSHIKI KAISHA (JP) 1988-02-17 EP disclosed