SCHEMBL8637610

SCHEMBL8637610

O=Cc1ccc2c3c(cccc13)C(=O)NC2=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.59
KMT2A Q03164 6/20 0.59
PARP1 P09874 4/20 0.59
USP2 O75604 3/20 0.59
POLB P06746 3/20 0.59
NPSR1 Q6W5P4 2/20 0.59
CASP7 P55210 2/20 0.59
RGS12 O14924 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
MAPT P10636 1/20 0.59
THRB P10828 1/20 0.59
CYP2C9 P11712 1/20 0.59
APEX1 P27695 1/20 0.59
CASP1 P29466 1/20 0.59
BRCA1 P38398 1/20 0.59
MTOR P42345 1/20 0.59
RECQL P46063 1/20 0.59
BLM P54132 1/20 0.59
GNAI1 P63096 1/20 0.59

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
SCHEMBL30678675 0.86 CDK5 (0.51) MEN1KMT2APARP1USP2POLB
SCHEMBL4199579 0.81 PABPC1 (0.55) MEN1KMT2ANPSR1CASP7CYP1A2
SCHEMBL28401578 0.79 PARP1 (0.47) MEN1KMT2APARP1USP2POLB
SCHEMBL18590078 0.78 MEN1 (0.62) MEN1KMT2APARP1USP2POLB
SCHEMBL5746359 0.76 MEN1 (0.65) MEN1KMT2APARP1USP2POLB
SCHEMBL21124 0.74 KMT2A (1.00) MEN1KMT2APARP1USP2POLB
SCHEMBL5746130 0.74 MEN1 (0.62) MEN1KMT2APARP1USP2POLB
SCHEMBL9968963 0.74 MEN1 (0.62) MEN1KMT2APARP1USP2POLB
SCHEMBL29941362 0.74 KMT2A (1.00) MEN1KMT2APARP1USP2POLB
SCHEMBL30517110 0.74 POLB (0.62) MEN1KMT2APARP1USP2POLB

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
US-5824559-A Method of analyzing 5-hydroxyindoles and catecholamines, and a device for performing the same LABORATORY OF MOLECULAR BIOPHOTONICS (JP) 1998-10-20 US disclosed