SCHEMBL28927985

SCHEMBL28927985

O=C(Cl)c1ccc(Cl)c2c(Cl)ccc(Cl)c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.41
ALOX15 P16050 1/20 0.38
KMT2A Q03164 2/20 0.38
ATM Q13315 1/20 0.38
TSHR P16473 4/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 1/20 0.37
HSD17B10 Q99714 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
TP53 P04637 1/20 0.37
CASP1 P29466 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 1/20 0.36
CYP1A2 P05177 1/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
DPP4 P27487 1/20 0.33
NR4A2 P43354 1/20 0.33
MAPK1 P28482 1/20 0.33
HIF1A Q16665 1/20 0.33

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
SCHEMBL338126 0.81 CYP1A2 (0.53) ALDH1A1ALOX15KMT2AATMTSHR
SCHEMBL11420001 0.75 CYP1A2 (0.70) ALDH1A1ALOX15KMT2ATSHRKDM4E
SCHEMBL967909 0.75 CYP3A4 (0.44) ALDH1A1ALOX15KMT2AATMTSHR
SCHEMBL28135908 0.73 DPP4 (0.46) ALDH1A1ALOX15KMT2AATMTSHR
SCHEMBL103521 0.73 ALDH1A1 (0.44) ALDH1A1ALOX15KMT2AATMTSHR
SCHEMBL29544731 0.71 HPGD (0.55) ALDH1A1ALOX15KMT2AATMTSHR
SCHEMBL9860903 0.71 HPGD (0.55) ALDH1A1ALOX15KMT2AATMTSHR
SCHEMBL7707415 0.71 ALDH1A1 (0.54) ALDH1A1ALOX15KMT2AATMTSHR
SCHEMBL9712335 0.71 ALDH1A1 (0.38) ALDH1A1ALOX15KMT2AATMTSHR
SCHEMBL9197919 0.71 ALDH1A1 (0.48) ALDH1A1ALOX15KMT2AATMTSHR

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-108368331-B Thermoplastic composition with low gloss and high impact strength 科思创有限公司 2022-05-13 CN disclosed