SCHEMBL3552650

SCHEMBL3552650

CSc1cc(-c2ccc(Oc3ccccc3)cc2)nn1C(=O)Nc1ccccc1.CSc1cc(-c2ccc(Oc3ccccc3)cc2)nn1C(=O)c1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.45
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 2/20 0.43
RAB9A P51151 2/20 0.43
GAA P10253 1/20 0.43
KLK7 P49862 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KLK14 Q9P0G3 1/20 0.43
KLK5 Q9Y337 1/20 0.43
ST14 Q9Y5Y6 1/20 0.43
F2 P00734 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ELANE P08246 1/20 0.42
MEN1 O00255 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PTPN1 P18031 1/20 0.41
FAAH O00519 2/20 0.41
LMNA P02545 1/20 0.41
ALOX12 P18054 1/20 0.41

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
SCHEMBL3367014 0.93 MAPT (0.47) MAPTKMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL1225270 0.92 KMT2A (0.50) MAPTKMT2AALDH1A1RAB9AGAA
SCHEMBL3365486 0.89 SMN1; SMN2 (0.42) MAPTKMT2AALDH1A1RAB9AHPGD
SCHEMBL3370342 0.84 KMT2A (0.45) MAPTKMT2AALDH1A1RAB9AGAA
SCHEMBL3367196 0.75 SCN4A (0.54) ALDH1A1RAB9ALMNAHTTNPC1
SCHEMBL3366888 0.69 HPGD (0.47) MAPTKMT2AALDH1A1RAB9AGAA
SCHEMBL11746060 0.68 MAPT (0.40) MAPTKMT2AALDH1A1RAB9ANPSR1
SCHEMBL6340449 0.64 ENPP3 (0.49) MAPTKMT2AALDH1A1RAB9AGAA
SCHEMBL10918704 0.64 CTRC (0.76)
SCHEMBL1531102 0.63 FAAH (0.49) MAPTKMT2ARAB9AGAAELANE

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-2266960-B1 Aryl-substituted pyrazoles, imidazoles, oxazoles, thiazoles and pyrroles as anticonvulsants EURO CELTIQUE SA (LU) 2014-01-22 EP disclosed
EP-2266960-A2 Aryl-substituted pyrazoles, imidazoles, oxazoles, thiazoles and pyrroles as anticonvulsants EURO-CELTIQUE S.A. (LU) 2010-12-29 EP disclosed