SCHEMBL8059294

SCHEMBL8059294

Cc1cccc(NC(=O)OCC(=O)c2ccc(S(=O)(=O)N(Cc3ccccc3)Cc3ccccc3)cc2C)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 5/20 0.53
MAPT P10636 7/20 0.47
ALDH1A1 P00352 2/20 0.47
HTT P42858 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
POLB P06746 1/20 0.46
LIMK1 P53667 1/20 0.46
LIMK2 P53671 1/20 0.46
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 3/20 0.44
RAB9A P51151 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA9 Q16790 1/20 0.43
TP53 P04637 3/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL8070266 0.93 MAPT (0.53) TAS2R14MAPTPOLBMAPK1SMN1; SMN2
SCHEMBL8073072 0.91 MAPT (0.54) TAS2R14MAPTPOLBLMNATP53
SCHEMBL8073250 0.90 TAS2R14 (0.61) TAS2R14MAPTALDH1A1HTTNPSR1
SCHEMBL8071658 0.87 MAPT (0.56) TAS2R14MAPTPOLBLMNATP53
SCHEMBL8070249 0.87 MAPT (0.49) TAS2R14MAPTALDH1A1POLBSMN1; SMN2
SCHEMBL8070407 0.87 MAPT (0.51) TAS2R14MAPTLMNA
SCHEMBL8059182 0.86 TAS2R14 (0.54) TAS2R14MAPTALDH1A1LMNA
SCHEMBL8059343 0.85 TP53 (0.49) TAS2R14MAPTPOLBLMNATP53
SCHEMBL8069707 0.85 PTPN1 (0.50) MAPTALDH1A1CA12CA1CA2
SCHEMBL8059119 0.79 MAPT (0.59) TAS2R14MAPTPOLBTP53

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-1017685-A1 NEW 2-(3H)-OXAZOLONE DERIVATIVES ALMIRALL-PRODESFARMA, S.A. (ES) 2000-07-12 EP disclosed
WO-1999014205-A1 NEW 2-(3H)-OXAZOLONE DERIVATIVES ALMIRALL PRODESFARMA S.A. (ES) 1999-03-25 WO disclosed