SCHEMBL7701316

SCHEMBL7701316

O=C(CCC1CCCC1)Nc1ccc(-c2oc(-c3ccccc3)nc2C(=O)N2CCN(c3ccccc3)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.46
LCK P06239 2/20 0.46
HCK P08631 2/20 0.46
SRC P12931 2/20 0.46
KDR P35968 2/20 0.46
USP2 O75604 1/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 3/20 0.42
GBA1 P04062 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 2/20 0.42
HIF1A Q16665 1/20 0.42
HTT P42858 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GFER P55789 1/20 0.41
CETP P11597 1/20 0.41

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
SCHEMBL7695331 0.87 USP2 (0.57) DGAT1L3MBTL1USP2TP53MAPT
SCHEMBL7701952 0.86 MAPT (0.54) DGAT1L3MBTL1USP2MAPTSMN1; SMN2
SCHEMBL7698887 0.85 ALDH1A1 (0.49) DGAT1MAPTSMN1; SMN2ALDH1A1HTT
SCHEMBL7699897 0.84 L3MBTL1 (0.51) DGAT1L3MBTL1USP2MAPTSMN1; SMN2
SCHEMBL7701794 0.84 SMN1; SMN2 (0.53) DGAT1L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL7699467 0.83 ALDH1A1 (0.52) DGAT1L3MBTL1USP2TP53MAPT
SCHEMBL7701960 0.83 DGAT1 (0.52) DGAT1L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL7697962 0.82 L3MBTL1 (0.56) DGAT1L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL7694001 0.82 MAPT (0.58) DGAT1L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL7696391 0.81 MAPT (0.54) DGAT1L3MBTL1USP2TP53MAPT

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