SCHEMBL11920017

SCHEMBL11920017

CCc1ccc(-n2c(SCc3nc(-c4ccccc4C)no3)nnc2-c2ccncc2)cc1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.80
▸ TP53 P04637 5/20 0.80
▸ SMN1; SMN2 Q16637 4/20 0.80
▸ TNKS2 Q9H2K2 7/20 0.69
▸ NPSR1 Q6W5P4 2/20 0.67
▸ TNKS O95271 4/20 0.65
▸ LMNA P02545 2/20 0.63
▸ HTT P42858 2/20 0.63
▸ THRB P10828 1/20 0.63
▸ ALDH1A1 P00352 3/20 0.62
▸ MEN1 O00255 1/20 0.62
▸ KMT2A Q03164 1/20 0.62
▸ CYP3A4 P08684 1/20 0.60
▸ CYP2D6 P10635 1/20 0.60
▸ CYP2C9 P11712 1/20 0.60
▸ SULT2A1 Q06520 1/20 0.60
▸ NR5A1 Q13285 1/20 0.60
▸ AXIN2 Q9Y2T1 1/20 0.60
▸ TSHR P16473 2/20 0.60
▸ MAPK1 P28482 1/20 0.59

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
SCHEMBL11920016 0.92 TP53 (0.84) MAPTTP53SMN1; SMN2TNKS2NPSR1
SCHEMBL11920018 0.89 TP53 (1.00) MAPTTP53SMN1; SMN2TNKS2NPSR1
SCHEMBL11919957 0.80 TP53 (0.69) MAPTTP53SMN1; SMN2TNKS2NPSR1
SCHEMBL16010756 0.79 TNKS2 (1.00) MAPTTP53SMN1; SMN2TNKS2NPSR1
SCHEMBL11919905 0.77 NPSR1 (0.77) MAPTTP53SMN1; SMN2TNKS2NPSR1
SCHEMBL13046998 0.77 NPSR1 (0.90) MAPTTP53SMN1; SMN2TNKS2NPSR1
SCHEMBL11919901 0.77 TP53 (1.00) MAPTTP53SMN1; SMN2TNKS2NPSR1
SCHEMBL11919942 0.75 LMNA (0.78) MAPTTP53SMN1; SMN2TNKS2NPSR1
SCHEMBL11919979 0.75 NPSR1 (0.87) MAPTTP53SMN1; SMN2TNKS2NPSR1
SCHEMBL11919898 0.75 TNKS2 (1.00) MAPTTP53SMN1; SMN2TNKS2NPSR1

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
US-8883827-B2 Azole derivatives as WTN pathway inhibitors OSLO UNIVERSITY HOSPITAL HF (NO) 2014-11-11 — — US disclosed
US-8883827-B2 Azole derivatives as WTN pathway inhibitors OSLO UNIVERSITY HOSPITAL HF (NO) 2014-11-11 — — US disclosed
US-20120208828-A1 Azole Derivatives as WTN Pathway Inhibitors OSLO UNIVERSITY HOSPITAL HF (NO) 2012-08-16 — — US disclosed
US-20120208828-A1 Azole Derivatives as WTN Pathway Inhibitors OSLO UNIVERSITY HOSPITAL HF (NO) 2012-08-16 — — 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-20120208828-A1 Azole Derivatives as WTN Pathway Inhibitors WNT1, AXIN2, WNT3 MAPT 2763/4885TP53 53/4885SMN1; SMN2 4708/4885

“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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