SCHEMBL4286940

SCHEMBL4286940

Cn1cc(NS(=O)(=O)Cc2ccccc2)cn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 4/20 0.50
HPGD P15428 3/20 0.50
KDM4E B2RXH2 3/20 0.50
ALOX15 P16050 1/20 0.49
HSD17B10 Q99714 1/20 0.49
PGR P06401 1/20 0.49
HDAC1 Q13547 1/20 0.48
AR P10275 1/20 0.48
MET P08581 1/20 0.47
IMPDH2 P12268 1/20 0.47
EGFR P00533 1/20 0.46
FGFR1 P11362 1/20 0.46
KDR P35968 1/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
ADRB2 P07550 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
NAMPT P43490 1/20 0.45

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
SCHEMBL4281646 0.81 KMT2A (0.50) KMT2AALDH1A1HPGDKDM4EALOX15
SCHEMBL23275617 0.79 JAK2 (0.51) METKDR
SCHEMBL31011096 0.79 HTT (0.47) KMT2AALDH1A1HPGDPGREGFR
SCHEMBL4289381 0.77 EGFR (0.70) KMT2AALDH1A1HPGDEGFRFGFR1
SCHEMBL23281896 0.77 JAK2 (0.51) METEGFR
SCHEMBL23275850 0.76 JAK2 (0.50) ALDH1A1KDM4EMET
SCHEMBL23275861 0.76 BUB1 (0.49) ALDH1A1HPGDKDM4EMET
SCHEMBL21183349 0.75 KMT2A (0.50) KMT2AALDH1A1HPGDKDM4EPGR
SCHEMBL633995 0.75 KMT2A (0.76) KMT2AALDH1A1HPGDKDM4EALOX15
SCHEMBL20769960 0.74 IMPDH2 (0.54) KMT2AALDH1A1HPGDKDM4EALOX15

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-20090156582-A1 Pyrazole Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090156582-A1 Pyrazole Compound GSK3B, GSK3A, GSKIP KMT2A 871/4885ALDH1A1 694/4885HPGD 2563/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.