SCHEMBL31454751

SCHEMBL31454751

Nc1ccc(Nc2ccccc2Nc2ccc(N)cc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.78
KDM4E B2RXH2 6/20 0.78
ALOX15 P16050 3/20 0.78
HSD17B10 Q99714 2/20 0.78
TP53 P04637 1/20 0.78
APP P05067 1/20 0.78
HPGD P15428 1/20 0.78
SNCA P37840 1/20 0.78
BLM P54132 1/20 0.78
SMN1; SMN2 Q16637 1/20 0.78
ALDH1A1 P00352 7/20 0.68
L3MBTL1 Q9Y468 4/20 0.68
HTT P42858 3/20 0.68
CYP1A2 P05177 2/20 0.68
CYP2C9 P11712 2/20 0.68
CYP2C19 P33261 2/20 0.68
ALOX12 P18054 2/20 0.68
CYP3A4 P08684 1/20 0.68
MAPK1 P28482 2/20 0.64
GAA P10253 7/20 0.56

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
SCHEMBL7011541 0.95 MAPT (0.77) MAPTKDM4EALOX15HSD17B10TP53
SCHEMBL1636651 0.88 MAPT (1.00) MAPTKDM4EALOX15HSD17B10TP53
Methane SCHEMBL28002603 0.86 MAPT (0.96) MAPTKDM4EALOX15HSD17B10TP53
SCHEMBL26698407 0.84 MAPT (0.64) MAPTKDM4EALOX15HSD17B10TP53
SCHEMBL7027050 0.84 MAPT (0.64) MAPTKDM4EALOX15HSD17B10TP53
SCHEMBL19302971 0.84 MAPT (0.64) MAPTKDM4EALOX15HSD17B10TP53
SCHEMBL1300022 0.84 MAPT (0.64) MAPTKDM4EALOX15HSD17B10TP53
SCHEMBL19185367 0.84 MAPT (0.64) MAPTKDM4EALOX15HSD17B10TP53
SCHEMBL6405773 0.81 ALDH1A1 (1.00) MAPTKDM4EALOX15HSD17B10TP53
SCHEMBL15371 0.81 ALDH1A1 (1.00) MAPTKDM4EALOX15HSD17B10TP53

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-119978367-A Black polyimide film and preparation method thereof 中国科学院长春应用化学研究所 2025-05-13 CN disclosed