SCHEMBL14973113

SCHEMBL14973113

Cn1ncc(C(=O)NNC(=O)c2cccc(S(N)(=O)=O)c2)c1CCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.41
TLR7 Q9NYK1 2/20 0.39
KAT6A Q92794 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SCN10A Q9Y5Y9 3/20 0.38
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
GAA P10253 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
DDR1 Q08345 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 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
SCHEMBL14973162 0.90 MEN1 (0.46) PTGS2MEN1KMT2ACA12CA1
SCHEMBL14973349 0.87 MAPT (0.44) PTGS2TLR7KAT6ASCN10AMAPT
SCHEMBL14973000 0.84 MRGPRX4 (0.45) PTGS2TLR7KAT6ASCN10ACA12
SCHEMBL14973309 0.79 MAPT (0.43) ALDH1A1MAPT
SCHEMBL14973345 0.76 CA12 (0.46) PTGS2TLR7CA12CA1CA2
SCHEMBL14973138 0.75 SIRT2 (0.37) MEN1KMT2ACA12CA1CA2
SCHEMBL14937463 0.75 CA9 (0.41) MEN1KMT2ACA12CA1CA2
SCHEMBL14973107 0.74 KDM4E (0.43) KMT2AALDH1A1MAPT
SCHEMBL14973305 0.74 TRPV1 (0.37) PTGS2CA12CA1CA2CA9
SCHEMBL14973167 0.73 ADAMTS4 (0.42) PTGS2TLR7CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8877944-B2 3-oxo-2,3-dihydro-1H-isoindole-4-carboxamides as PARP inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2014-11-04 US disclosed
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 PTGS2 1113/4885TLR7 2734/4885KAT6A 451/4885

“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.