SCHEMBL7698707

SCHEMBL7698707

CC(=O)Nc1ccc(-c2oc(-c3ccccc3)nc2C(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.53
HTT P42858 2/20 0.53
POLB P06746 1/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
KDM4C Q9H3R0 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
DGAT1 O75907 4/20 0.51
HTR2A P28223 1/20 0.49
GAA P10253 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HSD17B10 Q99714 1/20 0.49
ATM Q13315 1/20 0.48
CETP P11597 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 1/20 0.46
MAPK1 P28482 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 3/20 0.46
THRB P10828 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
SCHEMBL7697962 0.89 L3MBTL1 (0.56) POLBKDM4EALDH1A1TDP1DGAT1
SCHEMBL7699968 0.87 ATM (0.49) LMNAHTTPOLBKDM4EALDH1A1
SCHEMBL7695134 0.85 L3MBTL1 (0.48) KDM4EDGAT1GAAHSD17B10L3MBTL1
SCHEMBL7699994 0.81 ATM (0.47) LMNAHTTPOLBALDH1A1GAA
SCHEMBL7703324 0.79 L3MBTL1 (0.53) POLBKDM4EALDH1A1DGAT1GAA
SCHEMBL7693997 0.79 ATM (0.47) LMNAHTTPOLBKDM4EALDH1A1
SCHEMBL7696391 0.79 MAPT (0.54) HTTKDM4EALDH1A1DGAT1SMN1; SMN2
SCHEMBL7699897 0.79 L3MBTL1 (0.51) LMNAALDH1A1DGAT1GAASMN1; SMN2
SCHEMBL7695332 0.78 NPC1 (0.56) LMNAHTTPOLBKDM4EALDH1A1
SCHEMBL7695366 0.78 USP2 (0.56) LMNAHTTKDM4EALDH1A1DGAT1

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