SCHEMBL660756

SCHEMBL660756

Cc1sc2cnccc2c1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 2/20 0.34
RPS6KB1 P23443 1/20 0.33
CDK2 P24941 1/20 0.33
MAPKAPK2 P49137 1/20 0.33
GSK3B P49841 1/20 0.33
RPS6KA3 P51812 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
CASP1 P29466 1/20 0.33
HTT P42858 1/20 0.33
CASP7 P55210 1/20 0.33
NCOA1 Q15788 1/20 0.33
HSD17B10 Q99714 1/20 0.33
RCE1 Q9Y256 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33

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
SCHEMBL23330795 0.78 LPL (0.39) ALDH1A1HSD17B10
SCHEMBL19119787 0.74 SNCA (0.37) GSK3BRPS6KA3
SCHEMBL30445860 0.72 MAP3K7 (0.34)
SCHEMBL657279 0.72 MAP3K7 (0.34)
SCHEMBL18949718 0.71 CHUK (0.39) KDM4EALDH1A1HPGD
SCHEMBL13723718 0.70 KDM4E (0.41) RPS6KB1CDK2MAPKAPK2GSK3BRPS6KA3
SCHEMBL660127 0.67 KDM4E (0.40) RPS6KB1CDK2MAPKAPK2GSK3BRPS6KA3
SCHEMBL11914236 0.67 KDM4E (0.40) RPS6KB1CDK2MAPKAPK2GSK3BRPS6KA3
SCHEMBL2352761 0.66 LPL (0.34)
SCHEMBL2631244 0.66 LPL (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8378104-B2 7-aminofuropyridine derivatives OSI Pharmaceuticals, LLC (US) 2013-02-19 US disclosed
US-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI PHARMACEUTICALS, INC. 2012-02-23 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-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES MAP3K5, STK17A, MAPKAPK5 LATS1 189/4885RPS6KB1 273/4885CDK2 290/4885

“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.