SCHEMBL7695331

SCHEMBL7695331

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

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.57
HTT P42858 2/20 0.55
LMNA P02545 1/20 0.55
MAPT P10636 7/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
POLB P06746 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
DGAT1 O75907 2/20 0.49
TP53 P04637 2/20 0.48
KMT2A Q03164 1/20 0.48
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
GAA P10253 1/20 0.45
CETP P11597 1/20 0.45
HSD17B10 Q99714 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
CASP1 P29466 1/20 0.45

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
SCHEMBL7701952 0.90 MAPT (0.54) USP2HTTLMNAMAPTSMN1; SMN2
SCHEMBL7699467 0.88 ALDH1A1 (0.52) USP2MAPTSMN1; SMN2L3MBTL1DGAT1
SCHEMBL7699897 0.88 L3MBTL1 (0.51) USP2LMNAMAPTSMN1; SMN2L3MBTL1
SCHEMBL7701960 0.88 DGAT1 (0.52) HTTLMNAMAPTSMN1; SMN2L3MBTL1
SCHEMBL7701794 0.88 SMN1; SMN2 (0.53) HTTMAPTSMN1; SMN2POLBL3MBTL1
SCHEMBL7697962 0.88 L3MBTL1 (0.56) MAPTSMN1; SMN2POLBL3MBTL1DGAT1
SCHEMBL7701316 0.87 DGAT1 (0.49) USP2HTTLMNAMAPTSMN1; SMN2
SCHEMBL7694001 0.86 MAPT (0.58) HTTLMNAMAPTSMN1; SMN2L3MBTL1
SCHEMBL7703324 0.85 L3MBTL1 (0.53) MAPTSMN1; SMN2POLBL3MBTL1DGAT1
SCHEMBL7696391 0.85 MAPT (0.54) USP2HTTMAPTSMN1; SMN2L3MBTL1

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