SCHEMBL7699994

SCHEMBL7699994

CN(C)c1ccc(-c2oc(-c3ccccc3-c3ccccc3)nc2C(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.47
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
MAPK1 P28482 1/20 0.45
MAPT P10636 3/20 0.45
THRB P10828 2/20 0.45
TP53 P04637 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 5/20 0.45
TSHR P16473 3/20 0.45
HTT P42858 2/20 0.44
ALDH1A1 P00352 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CNR1 P21554 1/20 0.44
GAA P10253 1/20 0.44
POLB P06746 1/20 0.43

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
SCHEMBL7699968 0.94 ATM (0.49) ATMKMT2AMEN1MAPK1MAPT
SCHEMBL7703801 0.89 L3MBTL1 (0.49) KMT2AMEN1MAPTTP53TSHR
SCHEMBL7693997 0.82 ATM (0.47) ATMKMT2AMEN1MAPK1MAPT
SCHEMBL7696382 0.82 L3MBTL1 (0.58) KMT2AMEN1MAPTTP53SMN1; SMN2
SCHEMBL7698707 0.81 LMNA (0.53) ATMKMT2AMEN1MAPK1MAPT
SCHEMBL7694348 0.79 HTR2C (0.38) KMT2AMEN1MAPTTP53SMN1; SMN2
SCHEMBL7698990 0.79 HTR2C (0.43) KMT2AMEN1TP53SMN1; SMN2LMNA
SCHEMBL7699217 0.78 MAPT (0.36) KMT2AMEN1MAPK1MAPTTP53
SCHEMBL7701523 0.76 L3MBTL1 (0.49) KMT2AMEN1MAPK1MAPTTP53
SCHEMBL7695160 0.74 MAPT (0.41) KMT2AMEN1MAPK1MAPTTP53

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