SCHEMBL14973294

SCHEMBL14973294

Cn1ncc(-c2nc(-c3cccc(S(N)(=O)=O)c3)no2)c1-c1cnn(-c2ccc(Cl)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 13/20 0.48
CA2 P00918 12/20 0.48
CA1 P00915 9/20 0.48
CA12 O43570 7/20 0.48
S1PR1 P21453 2/20 0.41
CA4 P22748 1/20 0.41
CA13 Q8N1Q1 2/20 0.40
MAOB P27338 1/20 0.40
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
GRM1 Q13255 1/20 0.36
MAP4K4 O95819 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
SCHEMBL14973087 0.92 CA9 (0.48) CA9CA2CA1CA12S1PR1
SCHEMBL14973244 0.90 CA9 (0.48) CA9CA2CA1CA12S1PR1
SCHEMBL14972981 0.90 S1PR1 (0.45) CA9CA2CA1CA12S1PR1
SCHEMBL14972984 0.89 CA9 (0.46) CA9CA2CA1CA12S1PR1
SCHEMBL14973242 0.81 CA2 (0.43) CA9CA2CA1CA12S1PR1
SCHEMBL14973117 0.81 MAP4K4 (0.40) S1PR1RAB9AKMT2AMAP4K4
SCHEMBL14973154 0.79 MAPKAPK2 (0.47) CA9CA2CA1CA12S1PR1
SCHEMBL14973291 0.79 PTGS2 (0.45) CA9CA2CA1CA12S1PR1
SCHEMBL10058721 0.77 CA9 (0.48) CA9CA2CA1CA12S1PR1
SCHEMBL14972923 0.77 CA9 (0.60) CA9CA2CA1CA12S1PR1

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 4 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
US-20130137865-A1 HETEROARYL-PYRAZOLE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2013-05-30 US 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 CA9 4504/4885CA2 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.