SCHEMBL27439587

SCHEMBL27439587

C=Cc1ccccc1NN=Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 1/20 0.53
MEN1 O00255 9/20 0.51
KMT2A Q03164 9/20 0.51
RAB9A P51151 8/20 0.51
NPC1 O15118 6/20 0.51
TAAR1 Q96RJ0 1/20 0.46
MAPT P10636 8/20 0.42
ALDH1A1 P00352 5/20 0.42
LMNA P02545 3/20 0.42
HPGD P15428 2/20 0.42
DDX3X O00571 1/20 0.42
GAA P10253 6/20 0.42
KDM4E B2RXH2 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
CTH P32929 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
NQO2 P16083 1/20 0.41
MAPK1 P28482 1/20 0.41
TSHR P16473 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
SCHEMBL11574435 0.82 MEN1 (0.55) NOX1MEN1KMT2ARAB9ANPC1
SCHEMBL22877096 0.75 ALDH1A1 (0.35) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL5429720 0.74 RAB9A (0.57) NOX1MEN1KMT2ARAB9ANPC1
SCHEMBL17622670 0.73 ALDH1A1 (0.40) ALDH1A1TSHR
SCHEMBL11433940 0.71 NOX1 (0.53) NOX1MEN1KMT2ARAB9ANPC1
SCHEMBL15189346 0.70 MEN1 (0.60) NOX1MEN1KMT2ARAB9ANPC1
SCHEMBL1522387 0.70 NPC1 (0.74) NOX1MEN1KMT2ARAB9ANPC1
SCHEMBL1522386 0.70 NPC1 (0.74) NOX1MEN1KMT2ARAB9ANPC1
SCHEMBL16254534 0.70 NPC1 (0.74) NOX1MEN1KMT2ARAB9ANPC1
SCHEMBL14930492 0.70 ALDH1A1 (0.43) MEN1KMT2ARAB9AMAPTALDH1A1

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
CN-1120837-A Pyrazole derivatives NISSAN CHEMICAL IND LTD (JP) 1996-04-17 CN disclosed