SCHEMBL11190882

SCHEMBL11190882

CCOC(=O)c1cc(=O)c2cccc(Cl)c2[nH]1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.70
CCNB1 P14635 1/20 0.70
RXFP1 Q9HBX9 1/20 0.57
GLA P06280 2/20 0.52
GAA P10253 2/20 0.52
ALOX15 P16050 1/20 0.47
ALOX5 P09917 6/20 0.47
KDM4E B2RXH2 6/20 0.45
ALDH1A1 P00352 3/20 0.45
HPGD P15428 3/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.45
ATM Q13315 1/20 0.45
PLA2G7 Q13093 2/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL11180617 0.86 GAA (0.54) CDK1CCNB1GLAGAAALOX5
SCHEMBL11194586 0.83 GAA (0.76) CDK1CCNB1RXFP1GLAGAA
SCHEMBL6307061 0.82 CDK1 (0.75) CDK1CCNB1RXFP1GLAGAA
SCHEMBL8325034 0.82 CDK1 (0.63) CDK1CCNB1RXFP1GLAGAA
SCHEMBL5565082 0.78 KDM4E (0.62) GLAGAAALOX15KDM4EALDH1A1
SCHEMBL31437284 0.78 KDM4E (0.62) GLAGAAALOX15KDM4EALDH1A1
SCHEMBL11640545 0.77 GPR35 (0.64) CDK1CCNB1GLAGAAALOX15
SCHEMBL22042078 0.77 CDK1 (0.58) CDK1CCNB1RXFP1GLAGAA
SCHEMBL4044123 0.77 CDK1 (0.57) CDK1CCNB1GLAGAAALOX15
SCHEMBL4090248 0.77 CDK1 (0.57) CDK1CCNB1RXFP1GAAALOX5

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
US-4414416-A Certain diacetyl-amino-phenolic derivatives FISONS LIMITED (GB) 1983-11-08 US disclosed
US-4328341-A Process for preparing certain pyrano[3,2-g]quinoline 2,8-dicarboxylates and 4-oxo-quinoline-2-carboxylates FISONS LIMITED (GB) 1982-05-04 US disclosed