SCHEMBL9706652

SCHEMBL9706652

Cn1c2c(c(=O)n(-c3ccc(Cl)c(C(=O)O)c3)c1=O)CCCC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 0.50
CTSB P07858 1/20 0.50
L3MBTL1 Q9Y468 6/20 0.43
POLB P06746 6/20 0.43
ALDH1A1 P00352 6/20 0.43
CTDSP1 Q9GZU7 3/20 0.43
KDM4E B2RXH2 3/20 0.43
CASP6 P55212 2/20 0.43
NSD2 O96028 2/20 0.43
RECQL P46063 2/20 0.43
PKM P14618 1/20 0.43
APEX1 P27695 1/20 0.43
CASP3 P42574 1/20 0.43
CMA1 P23946 1/20 0.40
NOTUM Q6P988 2/20 0.39
TP53 P04637 2/20 0.39
THRB P10828 1/20 0.39
MYC P01106 3/20 0.39
NR4A1 P22736 1/20 0.39
MAPT P10636 2/20 0.36

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
SCHEMBL10649882 0.99 TDP1 (0.49) TDP1CTSBL3MBTL1POLBALDH1A1
SCHEMBL9706570 0.98 TDP1 (0.50) TDP1CTSBL3MBTL1POLBALDH1A1
SCHEMBL10649877 0.89 TP53 (0.38) TDP1CTSBL3MBTL1POLBALDH1A1
SCHEMBL10648522 0.85 KMT2A (0.45) TDP1CTSBL3MBTL1ALDH1A1KDM4E
SCHEMBL9706530 0.85 KDM4E (0.48) POLBALDH1A1KDM4ECMA1TP53
SCHEMBL9706603 0.85 SLC6A2 (0.37) TDP1CTSBL3MBTL1POLBALDH1A1
SCHEMBL9706591 0.83 KDM4E (0.51) ALDH1A1KDM4ECMA1TP53SMN1; SMN2
SCHEMBL9706695 0.83 TP53 (0.39) TDP1CTSBALDH1A1KDM4ECMA1
SCHEMBL10647260 0.83 SLC6A2 (0.39) TDP1CTSBL3MBTL1POLBALDH1A1
SCHEMBL9706537 0.81 TDP1 (0.44) TDP1CTSBL3MBTL1POLBALDH1A1

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
EP-0195346-B1 3-ARYL URACILES AND THEIR USE AS HERBICIDES CIBA-GEIGY AG (CH) 1992-06-24 EP claimed
US-4760163-A 3-(5-carboxy-4-substituted-phenyl)-(thio)uracil-esters and salts HOFFMANN-LAROCHE INC. (US) 1988-07-26 US disclosed
US-4746352-A HERBICIDES HOFFMANN-LA ROCHE INC. (US) 1988-05-24 US disclosed