SCHEMBL1014384

SCHEMBL1014384

NCc1cccc2c1C(=O)NC2=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.46
PARP1 P09874 5/20 0.44
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 3/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CASP3 P42574 4/20 0.41
CASP7 P55210 2/20 0.41
CASP2 P42575 1/20 0.41
CASP6 P55212 1/20 0.41
CASP8 Q14790 1/20 0.41
MEN1 O00255 2/20 0.41
POLB P06746 2/20 0.41
KMT2A Q03164 2/20 0.41
RGS12 O14924 1/20 0.41
USP2 O75604 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL10713059 0.84 GSK3B (0.50) GSK3BPARP1KDM4EALDH1A1GAA
SCHEMBL5970012 0.84 GSK3B (0.50) GSK3BPARP1KDM4EALDH1A1GAA
SCHEMBL2408327 0.82 KDM4E (0.49) GSK3BPARP1KDM4EALDH1A1GAA
SCHEMBL34459996 0.82 CDK2 (0.42) GSK3BPARP1KDM4EALDH1A1GAA
SCHEMBL8656528 0.82 CDK2 (0.42) GSK3BPARP1KDM4EALDH1A1GAA
SCHEMBL28550931 0.81 GSK3B (0.43) GSK3BPARP1KDM4EALDH1A1GAA
SCHEMBL2744968 0.81 GSK3B (0.46) GSK3BPARP1KDM4EALDH1A1GAA
SCHEMBL793085 0.81 KDM4E (0.47) GSK3BPARP1KDM4EALDH1A1GAA
SCHEMBL113006 0.81 GSK3B (0.46) GSK3BPARP1KDM4EALDH1A1GAA
SCHEMBL5167684 0.81 GSK3B (0.46) GSK3BPARP1KDM4EALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025094187-A1 A SINGLE STEP PROCESS FOR THE PREPARATION OF OMADACYCLINE TOSYLATE OF FORMULA (X) SUMAR BIOTECH LLP (IN) 2025-05-08 WO disclosed
EP-2042305-B1 Planographic printing plate precursor FUJIFILM CORP (JP) 2011-01-12 EP disclosed
EP-2042305-A2 Planographic printing plate precursor FUJIFILM Corporation (JP) 2009-04-01 EP disclosed
US-4950770-A Psoralens aminomethylation ELDER PHARMACEUTICALS, INC. (US) 1990-08-21 US disclosed