SCHEMBL6207517

SCHEMBL6207517

COc1ccc(C(C=O)(NC(=O)C(=O)O)c2ccc(OC)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
ATM Q13315 1/20 0.44
ALDH1A1 P00352 2/20 0.43
ALOX15 P16050 2/20 0.43
LMNA P02545 1/20 0.43
APEX1 P27695 1/20 0.43
MAPK1 P28482 1/20 0.43
RECQL P46063 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CA1 P00915 4/20 0.42
CA2 P00918 4/20 0.42
PLK1 P53350 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
TP53 P04637 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL3248430 0.74 ALDH1A1 (0.50) MAPTATMALDH1A1CA1CA2
SCHEMBL3248426 0.74 ALDH1A1 (0.50) MAPTATMALDH1A1CA1CA2
SCHEMBL11721311 0.68 RAB9A (0.68) MAPTALDH1A1ALOX15NPC1RAB9A
SCHEMBL1507665 0.67 CA1 (0.54) MAPTTHRBATMALDH1A1ALOX15
SCHEMBL21501142 0.67 CA1 (0.48) MAPTALDH1A1ALOX15LMNAAPEX1
SCHEMBL7358417 0.66 MAPT (0.53) MAPTALDH1A1ALOX15LMNAAPEX1
SCHEMBL2795435 0.66 CYP2C9 (0.55) MAPTALDH1A1ALOX15LMNAAPEX1
SCHEMBL4232572 0.66 CA1 (0.52) MAPTTHRBATMALDH1A1ALOX15
SCHEMBL20986637 0.66 KCNN4 (0.39) MAPTALDH1A1ALOX15MAPK1HSD17B10
SCHEMBL1939457 0.66 AKR1C3 (0.54) MAPTALDH1A1ALOX15LMNAAPEX1

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-1583749-A1 OXAZOLE DERIVATIVES AS INHIBITORS OF CYCLOOXYGENASE Astellas Pharma Inc. (JP) 2005-10-12 EP disclosed
WO-2004065374-A1 OXAZOLE DERIVATIVES AS INHIBITORS OF CYCLOOXYGENASE ASTELLAS PHARMA INC. (JP) 2004-08-05 WO disclosed