SCHEMBL9242174

SCHEMBL9242174

CCC(Oc1nc(Cl)c(Cl)cc1Cl)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
TDP1 Q9NUW8 2/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
ALOX12 P18054 1/20 0.42
MAPK1 P28482 1/20 0.42
ATM Q13315 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PPARA Q07869 8/20 0.38
PPARG P37231 6/20 0.38
PLAU P00749 3/20 0.38
PLG P00747 2/20 0.38
PLAT P00750 2/20 0.38
POLB P06746 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
SCHEMBL11562601 0.85 SMN1; SMN2 (0.42) SMN1; SMN2PPARAPPARGPLAUPLG
SCHEMBL11622740 0.80 TSHR (0.43) TDP1ALDH1A1CYP3A4MAPTALOX15
SCHEMBL15725286 0.78 L3MBTL1 (0.45) SMN1; SMN2TSHRMAPK1L3MBTL1PPARA
SCHEMBL20553152 0.78 L3MBTL1 (0.45) SMN1; SMN2TSHRMAPK1L3MBTL1PPARA
SCHEMBL8763648 0.76 TDP1 (0.38) TDP1ALDH1A1CYP3A4MAPTALOX15
SCHEMBL5162414 0.75 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1PPARAPPARG
SCHEMBL11623097 0.75 ALDH1A1 (0.44) SMN1; SMN2TDP1ALDH1A1CYP3A4MAPT
SCHEMBL6863626 0.74 SMN1; SMN2 (0.49) SMN1; SMN2TDP1ALDH1A1TSHRHSD17B10
SCHEMBL11561882 0.72 PPARG (0.35) TDP1MEN1KMT2APPARAPPARG
SCHEMBL10952157 0.72 TDP1 (0.46) TDP1ALDH1A1CYP3A4MAPTALOX15

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-7267804-A None JP disclosed
JP-H07267804-A HERBICIDE COMPOSITION IDEMITSU KOSAN CO LTD 1995-10-17 JP disclosed