SCHEMBL2574099

SCHEMBL2574099

O=C(O)c1ccc(-c2ccccc2)cc1NC(=O)c1ccc(-c2cccnc2)cc1OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 10/20 0.58
▸ SGMS2 Q8NHU3 1/20 0.55
▸ CYP11B1 P15538 2/20 0.51
▸ CYP11B2 P19099 2/20 0.51
▸ MET P08581 1/20 0.49
▸ HDAC1 Q13547 1/20 0.48
▸ SMPD1 P17405 1/20 0.48
▸ MKNK1 Q9BUB5 2/20 0.48
▸ MKNK2 Q9HBH9 2/20 0.48
▸ MCL1 Q07820 1/20 0.47

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
SCHEMBL2573789 0.93 LRRK2 (0.68) LRRK2SGMS2CYP11B1CYP11B2SMPD1
SCHEMBL1318330 0.88 LRRK2 (0.52) LRRK2SGMS2CYP11B1CYP11B2MET
SCHEMBL1315386 0.87 MCL1 (0.60) LRRK2SGMS2CYP11B1CYP11B2SMPD1
SCHEMBL12121482 0.87 MKNK1 (0.53) HDAC1MKNK1MKNK2
SCHEMBL20291171 0.87 SGMS2 (0.74) LRRK2SGMS2MET
SCHEMBL20291299 0.86 LRRK2 (0.68) LRRK2SGMS2CYP11B1CYP11B2MET
SCHEMBL2574796 0.84 LRRK2 (0.68) LRRK2MKNK2
SCHEMBL1316038 0.82 LRRK2 (0.61) LRRK2SGMS2CYP11B1CYP11B2HDAC1
SCHEMBL20290837 0.82 LRRK2 (0.85) LRRK2SGMS2MET
SCHEMBL12121601 0.82 LRRK2 (0.51) LRRK2MKNK1MKNK2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2385036-A1 N-ACYL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF Toyama Chemical Co., Ltd. (JP) 2011-11-09 — — EP disclosed
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