SCHEMBL659530

SCHEMBL659530

Fc1cc2c(Br)csc2cn1

nearest known ligand 0.31

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.31
MINK1 Q8N4C8 1/20 0.31
TNIK Q9UKE5 1/20 0.31
EGFR P00533 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
PPARG P37231 1/20 0.31
HTT P42858 1/20 0.31
NCOA2 Q15596 1/20 0.31
NCOA1 Q15788 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NCOA3 Q9Y6Q9 1/20 0.31
CYP2A6 P11509 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
SCHEMBL659873 0.76 ALDH1A1 (0.31) KDM4EALDH1A1MAPTHPGDPPARG
SCHEMBL19436190 0.72 ALDH1A1 (0.38) ALDH1A1CYP2A6
SCHEMBL658606 0.72 GABRP (0.38) EGFRKDM4EMAPTCYP2A6
SCHEMBL5230107 0.71 KDM4E (0.44) KDM4EALDH1A1MAPT
SCHEMBL25253123 0.70 CYP2A6 (0.33) CYP2A6
SCHEMBL660908 0.69 GABRA1 (0.41) ALDH1A1MAPT
SCHEMBL4861866 0.69 RXRA (0.35) KDM4EALDH1A1MAPT
SCHEMBL413347 0.67 MAPT (0.45) MAPTCYP2A6
SCHEMBL29431211 0.64
SCHEMBL15817287 0.64

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 MAP4K4 41/4885MINK1 95/4885TNIK 609/4885

“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.