SCHEMBL10824965

SCHEMBL10824965

O=[N+]([O-])c1cccc(Cl)c1Oc1ccc2ccccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.57
POLB P06746 1/20 0.57
PIN1 Q13526 2/20 0.55
ALDH1A1 P00352 4/20 0.53
GAA P10253 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.50
APEX1 P27695 1/20 0.48
HPGD P15428 1/20 0.48
BCL2L1 Q07817 1/20 0.46
MCL1 Q07820 1/20 0.46
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
HSPB1 P04792 1/20 0.40
GPR84 Q9NQS5 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PTPN7 P35236 1/20 0.39

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
SCHEMBL2326248 0.83 MAPT (0.64) MAPTPOLBPIN1ALDH1A1GAA
SCHEMBL7168591 0.82 MAPT (0.67) MAPTPOLBPIN1ALDH1A1GAA
SCHEMBL9818964 0.82 MAPT (0.67) MAPTPOLBALDH1A1GAASMN1; SMN2
SCHEMBL13720687 0.80 MAPT (0.64) MAPTPOLBALDH1A1GAASMN1; SMN2
SCHEMBL18162301 0.79 PIN1 (0.51) MAPTPIN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL11291316 0.79 PIN1 (0.51) MAPTPOLBPIN1ALDH1A1SMN1; SMN2
SCHEMBL13749241 0.79 MAPT (0.67) MAPTPOLBALDH1A1GAASMN1; SMN2
SCHEMBL7406297 0.78 MAPT (0.59) MAPTPOLBPIN1ALDH1A1GAA
SCHEMBL8486512 0.77 PIN1 (0.55) MAPTPIN1ALDH1A1GAASMN1; SMN2
SCHEMBL1020458 0.77 MAPT (0.61) MAPTPOLBPIN1ALDH1A1GAA

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
JP-61166860-A None JP disclosed
JP-S61166860-A NONALLERGIC AZO PIGMENT AND ITS PRODUCTION SHISEIDO CO LTD 1986-07-28 JP disclosed