SCHEMBL10488647

SCHEMBL10488647

CCOC(=O)c1c(Nc2ccc(C)cc2C)n[nH]c1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.57
POLB P06746 1/20 0.57
SMN1; SMN2 Q16637 4/20 0.55
LMNA P02545 4/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
KDM4E B2RXH2 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
GAA P10253 2/20 0.51
NPC1 O15118 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
PDE4D Q08499 1/20 0.50
AURKA O14965 3/20 0.47
CISD2 Q8N5K1 1/20 0.47
TP53 P04637 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL10488475 0.88 POLB (0.55) MAPTPOLBSMN1; SMN2LMNAMEN1
SCHEMBL10488676 0.85 MAPT (0.69) MAPTPOLBSMN1; SMN2LMNAKMT2A
SCHEMBL10488556 0.83 KMT2A (0.59) MAPTPOLBSMN1; SMN2LMNAMEN1
SCHEMBL10488603 0.81 POLB (0.55) MAPTPOLBSMN1; SMN2LMNAMEN1
SCHEMBL10488832 0.79 MAPT (0.61) MAPTPOLBSMN1; SMN2LMNAKMT2A
SCHEMBL7263569 0.79 MAPT (0.56) MAPTPOLBSMN1; SMN2LMNAKMT2A
SCHEMBL10488579 0.78 MAPT (0.66) MAPTPOLBSMN1; SMN2LMNAMEN1
SCHEMBL10488501 0.78 POLB (0.66) MAPTPOLBSMN1; SMN2LMNAKMT2A
SCHEMBL10488654 0.77 MAPT (0.78) MAPTPOLBSMN1; SMN2MEN1KMT2A
SCHEMBL10488775 0.77 SMN1; SMN2 (0.70) MAPTPOLBSMN1; SMN2MEN1KMT2A

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
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