SCHEMBL9749074

SCHEMBL9749074

C=CCOC(=N)Nc1nc(C)cc(C)n1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
KMT2A Q03164 5/20 0.37
MEN1 O00255 3/20 0.37
GAA P10253 1/20 0.37
MAPK1 P28482 1/20 0.37
KDM4E B2RXH2 2/20 0.36
RECQL P46063 1/20 0.36
ALDH1A1 P00352 1/20 0.36
RAB9A P51151 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
POLB P06746 1/20 0.35
THRB P10828 1/20 0.35
LMNA P02545 1/20 0.34

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
SCHEMBL9749082 0.81 MEN1 (0.41) KMT2AMEN1KDM4EALDH1A1
SCHEMBL9739707 0.76 KMT2A (0.47) MAPTKMT2AMEN1GAAMAPK1
SCHEMBL10504747 0.72 MEN1 (0.46) MAPTKMT2AMEN1GAAMAPK1
SCHEMBL10504753 0.72 MEN1 (0.46) MAPTKMT2AMEN1GAAMAPK1
SCHEMBL3455095 0.68 MAPT (0.55) MAPTKMT2AMEN1GAAMAPK1
SCHEMBL22804462 0.66 MAPT (0.48) MAPTKMT2AMEN1GAAMAPK1
SCHEMBL20034295 0.66 MAPT (0.44) MAPTKMT2AMEN1GAAMAPK1
SCHEMBL9741185 0.66 KMT2A (0.47) MAPTKMT2AMEN1KDM4ERECQL
SCHEMBL9739732 0.66 CYP1A2 (0.50) MAPTKMT2AMEN1KDM4ERECQL
SCHEMBL9749081 0.66 KMT2A (0.42) MAPTKMT2AMEN1MAPK1KDM4E

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-5126454-A PROCESS FOR THE PREPARATION OF SULPHONYLISOUREAS BAYER AKTIENGESELLSCHAFT (DE) 1992-06-30 US disclosed