SCHEMBL7696382

SCHEMBL7696382

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

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.58
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
POLB P06746 1/20 0.47
SLC6A7 Q99884 1/20 0.47
ALDH1A1 P00352 3/20 0.45
APOBEC3A P31941 1/20 0.44
CTDSP1 Q9GZU7 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
SCD O00767 1/20 0.44
SCD5 Q86SK9 1/20 0.44
MAPT P10636 3/20 0.44
TP53 P04637 2/20 0.44
DGAT1 O75907 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
USP2 O75604 1/20 0.42
TSHR P16473 1/20 0.42
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
NAMPT P43490 1/20 0.42

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
SCHEMBL7703801 0.92 L3MBTL1 (0.49) L3MBTL1KMT2AMEN1POLBSLC6A7
SCHEMBL7699968 0.88 ATM (0.49) L3MBTL1KMT2AMEN1POLBALDH1A1
SCHEMBL7698666 0.86 L3MBTL1 (0.44) L3MBTL1KMT2AMEN1ALDH1A1MAPT
SCHEMBL7694385 0.86 L3MBTL1 (0.58) L3MBTL1KMT2AMEN1POLBSLC6A7
SCHEMBL7696239 0.86 KMT2A (0.55) L3MBTL1KMT2AMEN1POLBALDH1A1
SCHEMBL7699803 0.85 NPC1 (0.44) L3MBTL1KMT2AMEN1ALDH1A1MAPT
SCHEMBL7701523 0.85 L3MBTL1 (0.49) L3MBTL1KMT2AMEN1POLBSLC6A7
SCHEMBL7700110 0.85 KDM4E (0.44) L3MBTL1KMT2AMEN1ALDH1A1MAPT
SCHEMBL7699889 0.84 L3MBTL1 (0.56) L3MBTL1KMT2AMEN1POLBSLC6A7
SCHEMBL7697962 0.84 L3MBTL1 (0.56) L3MBTL1KMT2AMEN1POLBSLC6A7

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