SCHEMBL1945213

SCHEMBL1945213

OCCCNc1nn2cc(-c3cccc(OC(F)(F)F)c3)nc2s1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 6/20 0.46
SYK P43405 1/20 0.44
PIM1 P11309 5/20 0.43
FYN P06241 1/20 0.43
PIM3 Q86V86 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
ACP1 P24666 1/20 0.41
DYRK1A Q13627 2/20 0.41
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
GAA P10253 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39

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
SCHEMBL1944086 0.86 F2RL3 (0.51) F2RL3SYKPIM1FYNDYRK1A
SCHEMBL1946084 0.86 F2RL3 (0.45) F2RL3SYKPIM1ACP1DYRK1A
SCHEMBL1945470 0.84 NAMPT (0.44) F2RL3SYKPIM1FYNDYRK1A
SCHEMBL1945163 0.84 F2RL3 (0.55) F2RL3SYKFYNMAPTTP53
SCHEMBL1945626 0.83 F2RL3 (0.47) F2RL3PIM1FYNDYRK1AMAPT
SCHEMBL1946612 0.83 F2RL3 (0.49) F2RL3FYNMAPTTP53GAA
SCHEMBL2253772 0.83 ACP1 (0.52) F2RL3PIM1PIM3PIM2ACP1
SCHEMBL1945253 0.83 PIM1 (0.47) F2RL3PIM1PIM3PIM2
SCHEMBL1947379 0.83 SYK (0.43) F2RL3SYKPIM1FYNACP1
SCHEMBL624084 0.83 F2RL3 (0.45) F2RL3PIM1PIM3PIM2ACP1

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 4 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-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 1121/4885SYK 1704/4885PIM1 72/4885

“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.