SCHEMBL7951482

SCHEMBL7951482

C=CC(N)Nc1ccc(Nc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.52
HSD17B10 Q99714 6/20 0.52
ALOX12 P18054 5/20 0.52
CYP3A4 P08684 5/20 0.52
TDP1 Q9NUW8 5/20 0.52
L3MBTL1 Q9Y468 4/20 0.52
TSHR P16473 4/20 0.52
ALOX15 P16050 3/20 0.52
LMNA P02545 2/20 0.52
THRB P10828 1/20 0.52
RECQL P46063 1/20 0.52
ATM Q13315 1/20 0.52
MAPK1 P28482 2/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
PTGS2 P35354 1/20 0.50
HTR2B P41595 1/20 0.50
MAPT P10636 7/20 0.47
HTT P42858 3/20 0.47
CYP1A2 P05177 1/20 0.47

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
SCHEMBL4964227 0.92 TDP1 (0.44) ALDH1A1HSD17B10ALOX12CYP3A4TDP1
SCHEMBL11884778 0.78 MAPT (0.37) ALDH1A1HSD17B10ALOX12CYP3A4TDP1
SCHEMBL2431450 0.74 ALDH1A1 (0.69) ALDH1A1HSD17B10ALOX12CYP3A4TDP1
SCHEMBL5498504 0.73 ALDH1A3 (0.37) ALDH1A1HSD17B10KDM4E
Diphenylamine SCHEMBL8598836 0.71 HSD17B10 (0.71) ALDH1A1HSD17B10ALOX12CYP3A4TDP1
SCHEMBL6822568 0.71 TDP1 (0.44) ALDH1A1HSD17B10ALOX12CYP3A4TDP1
SCHEMBL7896372 0.71 ALDH1A1 (1.00) ALDH1A1HSD17B10ALOX12CYP3A4TDP1
SCHEMBL13663470 0.71 ALDH1A1 (1.00) ALDH1A1HSD17B10ALOX12CYP3A4TDP1
SCHEMBL9480038 0.71 ALDH1A1 (1.00) ALDH1A1HSD17B10ALOX12CYP3A4TDP1
N,N'-Diphenyl-P-Phenylenediamine SCHEMBL42930 0.71 ALDH1A1 (1.00) ALDH1A1HSD17B10ALOX12CYP3A4TDP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116917441-A Stabilizer additive for synthetic raw materials derived from plastics 埃科莱布美国股份有限公司 2023-10-20 CN disclosed
CN-110337488-B Antifouling agent formulation for compressor 埃科莱布美国股份有限公司 2021-11-16 CN disclosed
US-6262323-B1 SYNERGISTIC MIXTURE OF PHENYLENEDIAMINE, STERIC HINDERED PHENOL AND HYDROXYLAMINE BAKER HUGHES INCORPORATED 2001-07-17 US disclosed