SCHEMBL7841530

SCHEMBL7841530

CCCCCCCCOc1ccc(-c2cnc(-c3ccc4cc(O)ccc4c3)nc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.56
RARB P10826 3/20 0.51
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
KDM4E B2RXH2 4/20 0.50
LTA4H P09960 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HSD17B10 Q99714 1/20 0.50
FTO Q9C0B1 1/20 0.49
MAPT P10636 1/20 0.45
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
ALDH1A1 P00352 3/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
PLA2G4B P0C869 1/20 0.44
HPGD P15428 2/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL7839694 0.91 NR5A1 (0.53) NR5A1RARBNPC1RAB9AKDM4E
SCHEMBL7849805 0.91 NR5A1 (0.53) NR5A1RARBNPC1RAB9AKDM4E
SCHEMBL9228047 0.88 NR5A1 (0.69) NR5A1RARBNPC1RAB9AKDM4E
SCHEMBL10337755 0.88 NR5A1 (0.69) NR5A1RARBNPC1RAB9AKDM4E
SCHEMBL9343934 0.88 NR5A1 (0.69) NR5A1RARBNPC1RAB9AKDM4E
SCHEMBL6255603 0.88 NR5A1 (0.69) NR5A1RARBNPC1RAB9AKDM4E
SCHEMBL10574379 0.88 NR5A1 (0.69) NR5A1RARBNPC1RAB9AKDM4E
SCHEMBL6254577 0.88 NR5A1 (0.69) NR5A1RARBNPC1RAB9AKDM4E
SCHEMBL28576384 0.88 NR5A1 (0.68) NR5A1RARBNPC1RAB9ALTA4H
SCHEMBL8396422 0.88 NR5A1 (0.52) NR5A1RARBNPC1RAB9AKDM4E

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-0751133-B1 Pyrimidine compound, and liquid crystal composition and liquid crystal element using the same MITSUI CHEMICALS INC (JP) 2001-09-12 EP disclosed
EP-0751133-A1 Pyrimidine compound, and liquid crystal composition and liquid crystal element using the same MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1997-01-02 EP disclosed