SCHEMBL14563248

SCHEMBL14563248

CN(C)CCCCNC(=O)Oc1ccc2oc(=O)n(Cc3ccc4[nH]c(=O)[nH]c4c3)c2c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MIF P14174 4/20 0.41
▸ CD74 P04233 2/20 0.41
▸ FAAH O00519 2/20 0.37
▸ ACHE P22303 6/20 0.37
▸ BCHE P06276 4/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ BRAF P15056 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ CBX7 O95931 1/20 0.36
▸ CDYL2 Q8N8U2 1/20 0.36
▸ CDYL Q9Y232 1/20 0.36
▸ CDY1; CDY1B Q9Y6F8 1/20 0.36

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
SCHEMBL14563146 0.94 MIF (0.43) MIFCD74ALDH1A1LMNATSHR
SCHEMBL2541369 0.86 TP53 (0.49) MIFALDH1A1LMNATP53
SCHEMBL3665095 0.81 MIF (0.51) MIFCD74ALDH1A1LMNATSHR
SCHEMBL3663233 0.80 MIF (0.48) MIFCD74ALDH1A1LMNATSHR
SCHEMBL2542481 0.79 TP53 (0.52) MIFALDH1A1LMNATP53
SCHEMBL2546842 0.74 MAPT (0.50) MIFCD74ALDH1A1LMNATSHR
SCHEMBL3631378 0.73 ACHE (0.48) MIFCD74ACHEBCHE
SCHEMBL2544424 0.71 MAPT (0.49) MIFCD74TP53
SCHEMBL3633760 0.71 ACHE (0.43) MIFCD74ACHEBCHE
SCHEMBL3627312 0.69 MET (0.40) FAAHACHEBCHE

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-2150551-B1 2-OXO-3-BENZYL-BENZOXAZOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS AS MET KINASE INHIBITORS FOR THE TREATMENT OF TUMORS MERCK PATENT GMBH (DE) 2013-01-16 — — EP claimed
EP-2150551-B1 2-OXO-3-BENZYL-BENZOXAZOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS AS MET KINASE INHIBITORS FOR THE TREATMENT OF TUMORS MERCK PATENT GMBH (DE) 2013-01-16 — — EP disclosed
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