SCHEMBL11920020

SCHEMBL11920020

c1ccc(Cn2c(SCCCc3nc(-c4ccncc4)no3)nnc2-c2ccncc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.57
▸ LMNA P02545 2/20 0.52
▸ HTT P42858 2/20 0.52
▸ TNKS2 Q9H2K2 3/20 0.51
▸ S1PR1 P21453 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ SMN1; SMN2 Q16637 5/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ TP53 P04637 2/20 0.48
▸ TNKS O95271 1/20 0.48
▸ RAB9A P51151 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL11920019 0.84 LMNA (0.69) LMNAHTTTNKS2ALDH1A1SMN1; SMN2
SCHEMBL13416534 0.68 S1PR1 (1.00) KDM4ELMNAHTTS1PR1ALDH1A1
SCHEMBL1544573 0.67 SMN1; SMN2 (0.59) LMNAHTTTNKS2ALDH1A1SMN1; SMN2
SCHEMBL11510339 0.67 KDM4E (0.77) KDM4ELMNAHTTALDH1A1SMN1; SMN2
SCHEMBL3915525 0.67 ALDH1A1 (0.67) KDM4ELMNAHTTALDH1A1SMN1; SMN2
SCHEMBL11919936 0.67 NPSR1 (0.58) LMNAHTTTNKS2ALDH1A1SMN1; SMN2
SCHEMBL13046997 0.67 NPSR1 (0.74) LMNAHTTTNKS2ALDH1A1SMN1; SMN2
SCHEMBL11919921 0.67 TNKS2 (0.76) LMNAHTTTNKS2SMN1; SMN2TP53
SCHEMBL29808136 0.66 TDP1 (0.50) ALDH1A1SMN1; SMN2RAB9ANPC1ATM
SCHEMBL11511071 0.66 KDM4E (0.57) KDM4ELMNAHTTALDH1A1SMN1; SMN2

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 5 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
WO-2010139966-A1 AZOLE DERIVATIVES AS WTN PATHWAY INHIBITORS OSLO UNIVERSITY HOSPITAL HF (NO) 2010-12-09 — — 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 (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 KDM4E 2794/4885LMNA 1015/4885HTT 4649/4885

“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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