SCHEMBL9901267

SCHEMBL9901267

CS(=O)(=O)c1ccc(C(=N)NNc2ccccc2Cl)nc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.41
AURKB Q96GD4 1/20 0.41
RORC P51449 1/20 0.40
P4HTM Q9NXG6 1/20 0.38
GRM4 Q14833 2/20 0.37
POLB P06746 1/20 0.37
CRHR1 P34998 3/20 0.36
GAA P10253 2/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
NPC1 O15118 1/20 0.36
PDE4B Q07343 1/20 0.35
MCL1 Q07820 1/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
MEN1 O00255 1/20 0.35
TSHR P16473 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL9901433 0.81 P4HTM (0.58) RORCP4HTMGRM4POLBGAA
SCHEMBL15441018 0.79 PTGS2 (0.38) PTGS2MEN1KMT2A
SCHEMBL9901196 0.71 LIPE (0.37) P4HTMGAAALDH1A1LMNAMEN1
SCHEMBL21595512 0.69 SMN1; SMN2 (0.61) RORCP4HTMGRM4NPC1LMNA
SCHEMBL30763154 0.69 SMN1; SMN2 (0.61) RORCP4HTMGRM4NPC1LMNA
SCHEMBL9901794 0.68 CA1 (0.39) AURKAAURKBRORCGAAPTGS2
SCHEMBL9901793 0.68 CA1 (0.39) AURKAAURKBRORCGAAPTGS2
SCHEMBL30628608 0.68 PRMT1 (0.40) RORCP4HTMPTGS2
SCHEMBL9926084 0.68 CA1 (0.41) AURKAAURKBRORCPOLBGAA
SCHEMBL10475124 0.66 POLB (0.50) POLBCRHR1GAANPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9403812-B2 Triazole derivatives as Wnt signaling pathway inhibitors OSLO UNIVERSITY HOSPITAL HF (NO) 2016-08-02 US disclosed
US-20150322057-A1 TRIAZOLE DERIVATIVES AS WNT SIGNALING PATHWAY INHIBITORS OSLO UNIVERSITY HOSPITAL HF (NO) 2015-11-12 US disclosed
US-9096587-B2 Triazole derivatives as Wnt signaling pathway inhibitors OSLO UNIVERSITY HOSPITAL HF (NO) 2015-08-04 US disclosed
US-20140031374-A1 TRIAZOLE DERIVATIVES AS WNT SIGNALING PATHWAY INHIBITORS OSLO University Hospital, HF (NO) 2014-01-30 US disclosed
EP-2649063-A1 TRIAZOLE DERIVATIVES AS WNT SIGNALING PATHWAY INHIBITORS Oslo University Hospital HF (NO) 2013-10-16 EP disclosed
WO-2012076898-A1 TRIAZOLE DERIVATIVES AS WNT SIGNALING PATHWAY INHIBITORS OSLO UNIVERSITY HOSPITAL HF (NO) 2012-06-14 WO 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 (2 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-20150322057-A1 TRIAZOLE DERIVATIVES AS WNT SIGNALING PATHWAY INHIBITORS CTNNB1, WNT1, CTNNA1 AURKA 1362/4885AURKB 820/4885RORC 36/4885
US-20140031374-A1 TRIAZOLE DERIVATIVES AS WNT SIGNALING PATHWAY INHIBITORS CTNNB1, WNT1, CTNNA1 AURKA 1303/4885AURKB 766/4885RORC 32/4885

“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.