SCHEMBL1944571

SCHEMBL1944571

FC(F)(F)c1cccc(-c2cn3nc(NCCc4ccccn4)sc3n2)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 5/20 0.52
CTSK P43235 1/20 0.43
KCNH2 Q12809 1/20 0.43
SYK P43405 1/20 0.40
GRIN1 Q05586 3/20 0.39
GRIN2B Q13224 3/20 0.39
CACNA1B Q00975 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
EPHB4 P54760 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
CHRM4 P08173 1/20 0.37
MKNK1 Q9BUB5 1/20 0.37
PIK3CA P42336 2/20 0.37
PIK3CB P42338 2/20 0.37
PIK3CG P48736 2/20 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
SCHEMBL1944370 0.88 F2RL3 (0.50) F2RL3SYKGRIN1GRIN2BMKNK1
SCHEMBL1947379 0.86 SYK (0.43) F2RL3CTSKKCNH2SYK
SCHEMBL1944192 0.86 TP53 (0.49) F2RL3MKNK1
SCHEMBL1947636 0.86 F2RL3 (0.50) F2RL3ALDH1A1MKNK1PIK3CAPIK3CB
SCHEMBL1944960 0.85 F2RL3 (0.54) F2RL3SYKEPHB4
SCHEMBL1944774 0.84 ACP1 (0.40) F2RL3MKNK1PIK3CA
SCHEMBL15603288 0.83 FYN (0.44) SYKMKNK1PIK3CAPIK3CBPIK3CG
SCHEMBL1946358 0.83 DCTPP1 (0.41) F2RL3MKNK1PIK3CAPIK3CBPIK3CG
SCHEMBL1944767 0.82 FYN (0.44) F2RL3HTTMKNK1
SCHEMBL1944085 0.82 POLB (0.41) F2RL3ALDH1A1MKNK1

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
EP-2307425-B1 IMIDAZOTHIADIAZOLES DERIVATIVES MERCK PATENT GMBH (DE) 2014-03-26 EP claimed
EP-2193133-B1 IMIDAZOLOTHIADIAZOLES FOR USE AS PROTEIN KINASE INHIBITORS FUNDACIÓN CT NAC DE INVESTIGACIONES ONCOLÓGICAS CARLOS III (ES) 2015-08-19 EP disclosed
EP-2307425-B1 IMIDAZOTHIADIAZOLES DERIVATIVES MERCK PATENT GMBH (DE) 2014-03-26 EP disclosed
US-8389554-B2 Imidazothiadiazole derivatives MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2013-03-05 US disclosed
US-20110130396-A1 IMIDAZOTHIADIAZOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-06-02 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-20110130396-A1 IMIDAZOTHIADIAZOLE DERIVATIVES TGFBR1, TGFBR2, IGF1R F2RL3 1121/4885CTSK 3469/4885KCNH2 3661/4885

“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.