SCHEMBL2954148

SCHEMBL2954148

COC(=O)c1ccc(O)c(C#N)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 2/20 0.43
▸ MAPK1 P28482 1/20 0.41
▸ CA12 O43570 3/20 0.40
▸ CA1 P00915 3/20 0.40
▸ CA2 P00918 3/20 0.40
▸ CA7 P43166 3/20 0.40
▸ CA9 Q16790 3/20 0.40
▸ CA14 Q9ULX7 3/20 0.40
▸ XDH P47989 1/20 0.40
▸ TRPM8 Q7Z2W7 1/20 0.38
▸ MAPT P10636 3/20 0.37
▸ GAA P10253 2/20 0.37
▸ CYP1A2 P05177 2/20 0.37
▸ TP53 P04637 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ RECQL P46063 1/20 0.37
▸ NPC1 O15118 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
SCHEMBL29549606 0.83 ALDH1A1 (0.43) MAPK1CA12CA1CA2CA7
SCHEMBL23554744 0.83 ALDH1A1 (0.43) MAPK1CA12CA1CA2CA7
SCHEMBL29877508 0.83 MAPK1 (0.41) MAPK1MAPTGAACYP1A2TP53
SCHEMBL28516114 0.82 MAPT (0.41) MAPK1MAPTGAACYP1A2TP53
SCHEMBL2968391 0.82 MAPT (0.42) MAPK1MAPTGAACYP1A2TP53
SCHEMBL29878249 0.81 NOTUM (0.42) MAPK1MAPTCYP1A2SMN1; SMN2KDM4E
SCHEMBL28574774 0.81 KDM4E (0.41) MAPK1TRPM8MAPTGAACYP1A2
SCHEMBL23554745 0.81 MAPK1 (0.39) MAPK1MAPTGAACYP1A2TP53
SCHEMBL16224715 0.77 GAA (0.50) MAPK1GAACYP1A2TP53SMN1; SMN2
SCHEMBL2129037 0.77 GAA (0.43) MAPK1TRPM8MAPTGAACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7737161-B2 Condensed furan compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-06-15 — — US disclosed
US-7737161-B2 Condensed furan compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-06-15 — — US disclosed
US-7737161-B2 Condensed furan compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-06-15 — — US disclosed
US-20090156803-A1 Condensed furan compounds KAWAGUCHI TAKAYUKI 2009-06-18 — — US disclosed
US-20090156803-A1 Condensed furan compounds KAWAGUCHI TAKAYUKI 2009-06-18 — — US disclosed
US-20090156803-A1 Condensed furan compounds KAWAGUCHI TAKAYUKI 2009-06-18 — — US disclosed
US-7514449-B2 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-04-07 — — US disclosed
US-7514449-B2 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-04-07 — — US disclosed
US-7514449-B2 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-04-07 — — US disclosed
US-20060094724-A1 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2006-05-04 — — US disclosed
EP-1582521-A1 FUSED FURAN COMPOUND TANABE SEIYAKU CO., LTD. (JP) 2005-10-05 — — EP 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-20090156803-A1 Condensed furan compounds F2, F12, F11 LCK 1187/4885MAPK1 3423/4885CA12 3253/4885
US-20060094724-A1 Fused furan compound F2, F12, F11 LCK 781/4885MAPK1 3611/4885CA12 3589/4885

“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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