SCHEMBL7672985

SCHEMBL7672985

CNc1ccc(C=O)c(NC)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.38
ALDH1A1 P00352 5/20 0.33
APP P05067 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
MEN1 O00255 2/20 0.33
BLM P54132 2/20 0.33
KMT2A Q03164 2/20 0.33
APAF1 O14727 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
PABPC1 P11940 1/20 0.33
MMP14 P50281 1/20 0.33
CASP6 P55212 1/20 0.33
TYR P14679 2/20 0.32
RECQL P46063 2/20 0.32
HSD17B10 Q99714 2/20 0.32
THRB P10828 2/20 0.32
TRIM24 O15164 1/20 0.32
TRIM33 Q9UPN9 1/20 0.32
CA12 O43570 1/20 0.32

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
SCHEMBL3178806 0.82 APP (0.37) EGFRALDH1A1APPTDP1MEN1
SCHEMBL4778640 0.81 APP (0.37) EGFRALDH1A1APPLMNA
SCHEMBL31450272 0.81 APP (0.37) EGFRALDH1A1APPLMNA
SCHEMBL4778642 0.81 APP (0.37) EGFRALDH1A1APPLMNA
SCHEMBL2766868 0.79 ALDH1A1 (0.45) EGFRALDH1A1APPTDP1MEN1
SCHEMBL28299604 0.79 ALDH1A1 (0.43) ALDH1A1CA1CA2HPGDTSHR
SCHEMBL23048251 0.78 TYR (0.52) EGFRALDH1A1APPTYRRECQL
SCHEMBL15982261 0.78 EGFR (0.37) EGFRALDH1A1APPTDP1MEN1
SCHEMBL4697903 0.78 TDP1 (0.55) EGFRALDH1A1TDP1MEN1KMT2A
SCHEMBL29953761 0.78 TYR (0.52) EGFRALDH1A1APPTYRRECQL

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6380197-B1 FOR TREATING AND PREVENTING A PLETHORA OF DISEASES INCLUDING DIABETES AVENTIS PHARMA S. A. (FR) 2002-04-30 US claimed
EP-1001943-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM Aventis Pharma S.A. (FR) 2000-05-24 EP claimed
WO-1999003843-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1999-01-28 WO claimed
US-6380197-B1 FOR TREATING AND PREVENTING A PLETHORA OF DISEASES INCLUDING DIABETES AVENTIS PHARMA S. A. (FR) 2002-04-30 US disclosed
EP-1001943-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM Aventis Pharma S.A. (FR) 2000-05-24 EP disclosed
WO-1999003843-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1999-01-28 WO disclosed