SCHEMBL14973167

SCHEMBL14973167

Cn1ncc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)cc2)c1COc1ccc(C(F)(F)F)cn1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 1/20 0.42
CA2 P00918 6/20 0.41
CA1 P00915 5/20 0.41
CA9 Q16790 5/20 0.41
CA12 O43570 4/20 0.41
MAOA P21397 4/20 0.41
MRGPRX4 Q96LA9 1/20 0.40
LMNA P02545 1/20 0.39
CA5A P35218 2/20 0.39
CHRNA7 P36544 1/20 0.39
MAOB P27338 2/20 0.38
PTGS2 P35354 1/20 0.38
TLR7 Q9NYK1 1/20 0.37
MAPT P10636 1/20 0.36

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
SCHEMBL14973000 0.91 MRGPRX4 (0.45) ADAMTS4CA2CA1CA9CA12
SCHEMBL14973345 0.89 CA12 (0.46) CA2CA1CA9CA12MAOA
SCHEMBL14973162 0.82 MEN1 (0.46) CA2CA1CA9CA12MAOA
SCHEMBL14973349 0.80 MAPT (0.44) MRGPRX4PTGS2TLR7MAPT
SCHEMBL14973138 0.79 SIRT2 (0.37) CA2CA1CA9CA12MAOA
SCHEMBL14938308 0.78 CA2 (0.38) ADAMTS4CA2CA1CA9CA12
SCHEMBL14972950 0.76 S1PR1 (0.46) ADAMTS4CA2CA1CA9CA12
SCHEMBL14973036 0.75 PTGS2 (0.46) CA2CA9CA12LMNACHRNA7
SCHEMBL14973183 0.75 CA2 (0.49) ADAMTS4CA2CA1MAOACHRNA7
SCHEMBL14973113 0.73 PTGS2 (0.41) CA2CA1CA9CA12PTGS2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2604602-A1 HETEROARYL-PYRAZOLE DERIVATIVE Taisho Pharmaceutical Co., Ltd. (JP) 2013-06-19 EP disclosed
US-20130137865-A1 HETEROARYL-PYRAZOLE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2013-05-30 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-20130137865-A1 HETEROARYL-PYRAZOLE DERIVATIVE GRIN2C, GRIN2B, GRIN3A ADAMTS4 4178/4885CA2 2244/4885CA1 1915/4885

“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.