SCHEMBL14973207

SCHEMBL14973207

Cn1ncc(-c2noc(-c3cccc(S(N)(=O)=O)c3)n2)c1COc1ccc(Cl)nc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 13/20 0.46
CA2 P00918 12/20 0.45
CA1 P00915 10/20 0.45
CA12 O43570 7/20 0.45
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA4 P22748 1/20 0.39
S1PR1 P21453 2/20 0.38
CA13 Q8N1Q1 3/20 0.37
HDAC1 Q13547 2/20 0.37
HDAC6 Q9UBN7 2/20 0.37
HDAC5 Q9UQL6 2/20 0.37
ALOX5AP P20292 1/20 0.36
MAOB P27338 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
SCHEMBL14973321 0.90 CA9 (0.46) CA9CA2CA1CA12S1PR1
SCHEMBL14973434 0.88 CA9 (0.48) CA9CA2CA1CA12MAPT
SCHEMBL10058721 0.86 CA9 (0.48) CA9CA2CA1CA12MAPT
SCHEMBL14973266 0.86 CA9 (0.52) CA9CA2CA1CA12NPC1
SCHEMBL14984860 0.86 S1PR1 (0.47) CA9CA2CA1CA12S1PR1
SCHEMBL14973315 0.86 CA9 (0.46) CA9CA2CA1CA12NPC1
SCHEMBL14972947 0.86 CA9 (0.48) CA9CA2CA1CA12CA4
SCHEMBL14973175 0.85 CA9 (0.47) CA9CA2CA1CA12CA4
SCHEMBL14973433 0.84 CA9 (0.46) CA9CA2CA1CA12CA4
SCHEMBL14973072 0.84 CA9 (0.49) CA9CA2CA1CA12NPC1

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.