SCHEMBL7730189

SCHEMBL7730189

COc1ccc(-c2nn(CC(C)C)c(=O)c(C)c2C(N)=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 4/20 0.43
HPGD P15428 3/20 0.43
NTRK1 P04629 1/20 0.42
PIM1 P11309 1/20 0.42
SRC P12931 2/20 0.40
PSMB1 P20618 1/20 0.40
PSMB5 P28074 1/20 0.40
GAA P10253 3/20 0.40
GLA P06280 1/20 0.40
HTT P42858 1/20 0.39
MAPT P10636 2/20 0.39
BTK Q06187 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
PIK3CD O00329 1/20 0.37

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
SCHEMBL6259201 0.86 KDM4E (0.43) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL6256484 0.78 KDM4E (0.43) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL6257629 0.77 POLB (0.56) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL6260924 0.77 MEN1 (0.43) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL6254976 0.76 KDM4E (0.41) ALDH1A1KDM4EHPGDPSMB1PSMB5
SCHEMBL6254981 0.76 KDM4E (0.48) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL6256148 0.74 MEN1 (0.43) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL6260962 0.73 TP53 (0.53) ALDH1A1KDM4EHPGDNTRK1PIM1
SCHEMBL6258095 0.72 AURKA (0.49) KDM4EPIK3CDTHRBRXFP1
SCHEMBL6260233 0.71 GRM2 (0.47) MEN1KMT2AALDH1A1KDM4EHPGD

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-6403586-B1 Pyridazine derivatives and drugs containing the same as the active ingredient KOWA CO., LTD. (JP) 2002-06-11 US disclosed