SCHEMBL7701088

SCHEMBL7701088

CCc1ccc(C(=O)Nc2ccc(-c3oc(-c4ccccc4)nc3C(=O)O)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.53
TP53 P04637 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
DGAT1 O75907 1/20 0.52
POLB P06746 2/20 0.50
KDM4E B2RXH2 1/20 0.49
GAA P10253 1/20 0.49
NR1H4 Q96RI1 1/20 0.49
IL6 P05231 1/20 0.48
STAT3 P40763 1/20 0.48
RXFP1 Q9HBX9 1/20 0.47
ADCY1 Q08828 1/20 0.47
PCSK9 Q8NBP7 1/20 0.46
PPARG P37231 1/20 0.46

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
SCHEMBL7701897 0.88 KDM4E (0.55) MAPTSMN1; SMN2KDM4EGAARXFP1
SCHEMBL7695319 0.86 MAPT (0.57) MAPTTP53SMN1; SMN2POLBKDM4E
SCHEMBL7704976 0.85 MAPT (0.61) MAPTTP53SMN1; SMN2POLBKDM4E
SCHEMBL7699501 0.84 MAPT (0.55) MAPTDGAT1POLB
SCHEMBL7701962 0.82 TAOK1 (0.54) MAPTTP53SMN1; SMN2DGAT1POLB
SCHEMBL7703221 0.82 RAB9A (0.67) MAPTTP53SMN1; SMN2DGAT1KDM4E
SCHEMBL7697940 0.81 MAPT (0.57) MAPTTP53SMN1; SMN2POLBKDM4E
SCHEMBL7693588 0.81 KDM4E (0.65) MAPTTP53SMN1; SMN2POLBKDM4E
SCHEMBL7701405 0.80 NPC1 (0.56) MAPTTP53SMN1; SMN2DGAT1POLB
SCHEMBL12829331 0.80 NR1H4 (0.73) MAPTTP53SMN1; SMN2POLBGAA

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
WO-2002064558-A2 OXAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS CYTOKINE INHIBITORS SANKYO COMPANY, LIMITED (JP) 2002-08-22 WO disclosed