SCHEMBL9347674

SCHEMBL9347674

CCCCc1ccc(-c2cnc(-c3ccc(OCC(C)OC(=O)CCC)cc3)nc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.41
RAB9A P51151 6/20 0.41
KDM4E B2RXH2 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MAPT P10636 3/20 0.41
HSD17B10 Q99714 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
NPC1 O15118 4/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
PLA2G4A P47712 1/20 0.38
S1PR1 P21453 1/20 0.38

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
SCHEMBL9345133 1.00 RARB (0.41) RARBRAB9AKDM4ESMN1; SMN2MAPT
SCHEMBL9347723 0.96 RARB (0.47) RARBRAB9AKDM4ESMN1; SMN2MAPT
SCHEMBL9344965 0.96 RARB (0.47) RARBRAB9AKDM4ESMN1; SMN2MAPT
SCHEMBL9343870 0.96 RARB (0.41) RARBRAB9AKDM4ESMN1; SMN2MAPT
SCHEMBL9343866 0.96 RARB (0.41) RARBRAB9AKDM4ESMN1; SMN2MAPT
SCHEMBL9345245 0.92 RARB (0.47) RARBRAB9AKDM4ESMN1; SMN2MAPT
SCHEMBL9345188 0.92 RARB (0.47) RARBRAB9AKDM4ESMN1; SMN2MAPT
SCHEMBL9343268 0.92 RARB (0.47) RARBRAB9AKDM4ESMN1; SMN2MAPT
SCHEMBL9342968 0.92 RARB (0.47) RARBRAB9AKDM4ESMN1; SMN2MAPT
SCHEMBL9347977 0.92 RARB (0.47) RARBRAB9AKDM4ESMN1; SMN2MAPT

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-0313284-B1 2,5-Diphenyl pyrimidine compounds and liquid crystal compositions containing them CHISSO CORP (JP) 1994-07-27 EP disclosed
US-4900472-A QUICK RESPONSE CHISSO CORPORATION (JP) 1990-02-13 US disclosed
EP-0313284-A2 2,5-Diphenyl pyrimidine compounds and liquid crystal compositions containing them Chisso Corporation (JP) 1989-04-26 EP disclosed