SCHEMBL10429474

SCHEMBL10429474

Oc1cc(O)nc(Nc2cccc(Cl)c2)n1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.54
GAA P10253 1/20 0.54
SYK P43405 1/20 0.51
HDAC3 O15379 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
PDPK1 O15530 1/20 0.49
JAK2 O60674 1/20 0.49
CDK2 P24941 1/20 0.49
FLT3 P36888 1/20 0.49
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 1/20 0.49
MEN1 O00255 2/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP1A2 P05177 1/20 0.48
POLB P06746 1/20 0.48
HSP90AA1 P07900 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48

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
SCHEMBL4255796 0.83 ABL1 (0.59) MAPTSYKCDK2MAPK1MAOB
SCHEMBL4544836 0.81 KMT2A (0.66) MAPTGAASYKKMT2AALDH1A1
SCHEMBL8526184 0.81 NFKB1 (0.69) MAPTGAASYKHDAC3HDAC1
SCHEMBL9506899 0.79 POLB (0.49) MAPTGAAHDAC3HDAC1HDAC2
SCHEMBL9505971 0.79 MEN1 (0.55) MAPTGAAKMT2AALDH1A1MEN1
SCHEMBL11291398 0.79 SYK (0.59) MAPTGAASYKHDAC3HDAC1
SCHEMBL14869861 0.79 MAPT (0.62) MAPTGAASYKKMT2AALDH1A1
SCHEMBL3957572 0.79 MAPT (0.58) MAPTGAASYKKMT2AALDH1A1
SCHEMBL4544826 0.77 NFKB1 (0.73) MAPTGAASYKKMT2AALDH1A1
SCHEMBL4544792 0.77 NFKB1 (0.73) MAPTGAASYKKMT2AALDH1A1

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-4942225-A Preparation of diazo and azo compounds using azidoformamidium salts BAYER AKTIENGESELLSCHAFT (DE) 1990-07-17 US disclosed