SCHEMBL14731124

SCHEMBL14731124

Cc1cccc(-c2nc(-c3cccc(C)n3)nc3c2CCCCC3)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 3/20 0.43
NPSR1 Q6W5P4 3/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
ALPL P05186 1/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
KDM4E B2RXH2 2/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TSHR P16473 1/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
EEF2K O00418 1/20 0.40
SMN1; SMN2 Q16637 1/20 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
SCHEMBL14731120 0.99 MAPT (0.44) MAPTKMT2AALDH1A1NPSR1MEN1
SCHEMBL14731022 0.96 MAPT (0.42) MAPTKMT2AALDH1A1NPSR1MEN1
SCHEMBL14731125 0.89 LMNA (0.43) MAPTALDH1A1NPC1RAB9AKDM4E
SCHEMBL14731035 0.88 ALDH1A1 (0.40) MAPTALDH1A1NPSR1HTTNPC1
SCHEMBL14731044 0.88 MAPT (0.38) MAPTKMT2AALDH1A1NPSR1MEN1
SCHEMBL14731127 0.88 THRB (0.44) MAPTALDH1A1NPC1RAB9AKDM4E
SCHEMBL14722704 0.87 LMNA (0.44) MAPTNPC1RAB9AKDM4EHSD17B10
SCHEMBL14730960 0.87 TGFBR1 (0.40) MAPTKMT2AALDH1A1NPSR1MEN1
SCHEMBL14731061 0.87 ALDH1A1 (0.40) MAPTALDH1A1NPSR1HTTNPC1
SCHEMBL14731034 0.86 MAPT (0.38) MAPTKMT2AALDH1A1NPSR1MEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013026900-A1 PYRIDINE DERIVATIVES AS MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2013-02-28 WO disclosed