SCHEMBL14730960

SCHEMBL14730960

CSc1cccc(-c2nc(-c3cccc(C)n3)nc3c2CCCCC3)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 2/20 0.40
LMNA P02545 1/20 0.36
KMT2A Q03164 2/20 0.35
MAPT P10636 4/20 0.35
NPSR1 Q6W5P4 2/20 0.35
HTT P42858 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KDM4E B2RXH2 2/20 0.33
CCR1 P32246 1/20 0.33
CCR8 P51685 1/20 0.33
GRM5 P41594 1/20 0.33
USP2 O75604 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALPL P05186 1/20 0.33
NPC1 O15118 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL14731139 0.99 TGFBR1 (0.41) TGFBR1LMNAKMT2AMAPTNPSR1
SCHEMBL14731042 0.97 TGFBR1 (0.41) TGFBR1LMNAKMT2AMAPTNPSR1
SCHEMBL14731124 0.87 MAPT (0.43) LMNAKMT2AMAPTNPSR1HTT
SCHEMBL14731120 0.86 MAPT (0.44) LMNAKMT2AMAPTNPSR1HTT
SCHEMBL14731125 0.86 LMNA (0.43) TGFBR1LMNAMAPTALDH1A1KDM4E
SCHEMBL14731035 0.85 ALDH1A1 (0.40) TGFBR1LMNAMAPTNPSR1HTT
SCHEMBL14731044 0.85 MAPT (0.38) TGFBR1LMNAKMT2AMAPTNPSR1
SCHEMBL14722704 0.84 LMNA (0.44) TGFBR1LMNAMAPTKDM4ECCR1
SCHEMBL14731061 0.84 ALDH1A1 (0.40) TGFBR1LMNAMAPTNPSR1HTT
SCHEMBL14731034 0.83 MAPT (0.38) TGFBR1LMNAKMT2AMAPTNPSR1

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