SCHEMBL10488563

SCHEMBL10488563

CCOC(=O)c1c(Nc2cccc(Cl)c2)n[nH]c1C

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.56
ALOX5 P09917 2/20 0.54
MAPT P10636 5/20 0.54
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 2/20 0.54
PTGES O14684 1/20 0.53
POLB P06746 1/20 0.53
TRPV1 Q8NER1 1/20 0.50
HPGD P15428 1/20 0.50
FADS1 O60427 4/20 0.48
PDE4D Q08499 1/20 0.48
MAPK1 P28482 1/20 0.47
GAA P10253 1/20 0.47
AURKA O14965 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL10488775 0.85 SMN1; SMN2 (0.70) SMN1; SMN2ALOX5MAPTPOLBHPGD
SCHEMBL10488620 0.84 SMN1; SMN2 (0.54) SMN1; SMN2MAPTALDH1A1KDM4EPOLB
SCHEMBL10488935 0.84 EGFR (0.54) SMN1; SMN2HPGDFADS1MAPK1
SCHEMBL10488603 0.84 POLB (0.55) SMN1; SMN2MAPTALDH1A1POLBHPGD
SCHEMBL10488958 0.82 SMN1; SMN2 (0.59) SMN1; SMN2MAPTKDM4EPOLBPDE4D
SCHEMBL10488475 0.81 POLB (0.55) SMN1; SMN2MAPTALDH1A1POLBHPGD
SCHEMBL10488614 0.79 SMN1; SMN2 (0.56) SMN1; SMN2MAPTPOLBPDE4DMAPK1
SCHEMBL10488579 0.79 MAPT (0.66) SMN1; SMN2MAPTALDH1A1POLBPDE4D
SCHEMBL10488746 0.78 SMN1; SMN2 (0.60) SMN1; SMN2MAPTKDM4EPOLBPDE4D
SCHEMBL10488676 0.76 MAPT (0.69) SMN1; SMN2MAPTALDH1A1POLBHPGD

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-0315433-A2 3-amino-5-methyl-1H-pyrazole-4-carboxylic acids and esters thereof as anticonvulsants, muscle relaxants and anxiolytics A.H. ROBINS COMPANY, INCORPORATED (US) 1989-05-10 EP claimed
US-4826866-A 3-amino-5-methyl-1H-pyrazole-4-carboxylic acids and esters thereof as anticonvulsants, muscle relaxants and anxiolytics A. H. ROBINS COMPANY, INCORPORATED (US) 1989-05-02 US claimed
EP-0315433-A2 3-amino-5-methyl-1H-pyrazole-4-carboxylic acids and esters thereof as anticonvulsants, muscle relaxants and anxiolytics A.H. ROBINS COMPANY, INCORPORATED (US) 1989-05-10 EP disclosed