SCHEMBL9901707

SCHEMBL9901707

N#Cc1ccc(-c2nnc(C=Cc3nnc(-c4ccc(OCC(F)(F)F)cn4)n3-c3ccccc3Cl)o2)cc1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TNKS2 Q9H2K2 12/20 0.68
▸ TNKS O95271 11/20 0.68
▸ SULT2A1 Q06520 1/20 0.68
▸ ALDH1A1 P00352 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ TLR8 Q9NR97 1/20 0.33
▸ METAP2 P50579 1/20 0.32
▸ HPGD P15428 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ PKM P14618 2/20 0.31
▸ USP2 O75604 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ CETP P11597 1/20 0.31
▸ NPC1 O15118 1/20 0.30

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
SCHEMBL9901703 1.00 TNKS2 (0.68) TNKS2TNKSSULT2A1ALDH1A1RECQL
SCHEMBL15449865 0.85 TNKS2 (0.79) TNKS2TNKSSULT2A1METAP2HPGD
SCHEMBL23059592 0.82 TNKS2 (0.75) TNKS2TNKSSULT2A1METAP2HPGD
SCHEMBL9926083 0.81 TNKS2 (0.45) TNKS2TNKSSULT2A1
SCHEMBL9904844 0.81 TNKS2 (1.00) TNKS2TNKSSULT2A1METAP2HPGD
SCHEMBL29372843 0.81 TNKS2 (1.00) TNKS2TNKSSULT2A1METAP2HPGD
SCHEMBL35212190 0.81 TNKS2 (1.00) TNKS2TNKSSULT2A1METAP2HPGD
SCHEMBL9904845 0.81 TNKS2 (1.00) TNKS2TNKSSULT2A1METAP2HPGD
SCHEMBL9904973 0.78 TNKS2 (0.43) TNKS2TNKSSULT2A1ALDH1A1MAPT
SCHEMBL15452796 0.78 TNKS2 (0.43) TNKS2TNKSSULT2A1ALDH1A1MAPT

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 TNKS2 167/4885TNKS 118/4885SULT2A1 1173/4885
US-20140031374-A1 TRIAZOLE DERIVATIVES AS WNT SIGNALING PATHWAY INHIBITORS CTNNB1, WNT1, CTNNA1 TNKS2 191/4885TNKS 145/4885SULT2A1 1203/4885

“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.

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