SCHEMBL1947217

SCHEMBL1947217

OC1CCC(Nc2nn3c(-c4ccccc4Cl)cnc3s2)CC1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FYN P06241 13/20 0.68
▸ HASPIN Q8TF76 1/20 0.48
▸ PIM1 P11309 2/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ MAPK14 Q16539 2/20 0.41
▸ MKNK1 Q9BUB5 1/20 0.39
▸ CCNT1 O60563 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
SCHEMBL1945736 0.89 FYN (0.63) FYNHASPINMAPK14MKNK1
SCHEMBL1946927 0.86 FYN (0.80) FYNHASPINPIM1KCNH2MKNK1
SCHEMBL1946393 0.85 FYN (0.65) FYNHASPINPIM1KCNH2MKNK1
SCHEMBL1944213 0.84 FYN (0.81) FYNHASPINPIM1KCNH2MKNK1
SCHEMBL1946285 0.81 FYN (1.00) FYNHASPINPIM1KCNH2MKNK1
SCHEMBL1946949 0.81 FYN (1.00) FYNHASPINPIM1KCNH2MKNK1
SCHEMBL1946141 0.81 FYN (0.71) FYNHASPINPIM1KCNH2
SCHEMBL1945406 0.79 FYN (0.76) FYNHASPINMKNK1
SCHEMBL3030025 0.79 PIM1 (0.67) PIM1KCNH2MKNK1
SCHEMBL3030028 0.79 PIM1 (0.67) PIM1KCNH2MKNK1

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 8 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-8389554-B2 Imidazothiadiazole derivatives MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2013-03-05 — — US 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
US-20110130396-A1 IMIDAZOTHIADIAZOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-06-02 — — 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 FYN 1977/4885HASPIN 2028/4885PIM1 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.

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