SCHEMBL9705307

SCHEMBL9705307

Cc1cc(-c2ccc(Cl)cc2)nc(-c2ccc(Cl)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.51
RAB9A P51151 5/20 0.51
MAPT P10636 5/20 0.50
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CTRC Q99895 2/20 0.49
TP53 P04637 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GAA P10253 2/20 0.47
CXCL12 P48061 1/20 0.46
PKM P14618 1/20 0.46
SCN2A Q99250 1/20 0.45
SCN10A Q9Y5Y9 1/20 0.45
MGAM O43451 1/20 0.45
SI P14410 1/20 0.45

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
SCHEMBL3563211 0.86 GAA (0.47) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL12264964 0.83 MEN1 (0.55) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL32681303 0.80 CTRC (0.56) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL4657928 0.79 ALOX5 (0.47) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL32681317 0.78 CTRC (0.54) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL16376441 0.77 MEN1 (0.60) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL17756652 0.77 MEN1 (0.60) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL13559277 0.77 MAPT (0.53) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL1256026 0.77 L3MBTL1 (0.55) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL2614936 0.77 CXCL12 (0.54) NPC1RAB9AMAPTKDM4EALDH1A1

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-0463492-A1 2,6-Diarylpyridin derivatives BAYER AG (DE) 1992-01-02 EP claimed
EP-0463492-A1 2,6-Diarylpyridin derivatives BAYER AG (DE) 1992-01-02 EP disclosed