SCHEMBL2469402

SCHEMBL2469402

Nc1cccc(Cn2nc(-c3cc(F)c(F)c(F)c3)ccc2=O)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 12/20 0.53
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ CHEK1 O14757 1/20 0.49
▸ NEK2 P51955 1/20 0.49
▸ LIMK1 P53667 1/20 0.49
▸ TYRO3 Q06418 1/20 0.49
▸ CLK4 Q9HAZ1 1/20 0.49
▸ HDAC1 Q13547 1/20 0.46
▸ MAPT P10636 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL2464345 0.89 MEN1 (0.52) METMEN1KMT2ACHEK1NEK2
SCHEMBL1952616 0.89 MET (0.65) METMEN1KMT2ACHEK1NEK2
SCHEMBL2468033 0.86 MEN1 (0.57) METMEN1KMT2AHDAC1MAPT
SCHEMBL3092398 0.86 MET (0.67) METHDAC1
SCHEMBL3840345 0.85 POLB (0.57) METMEN1KMT2ACHEK1NEK2
SCHEMBL2152563 0.84 HDAC1 (0.47) METMEN1KMT2AHDAC1
SCHEMBL3632471 0.83 MET (0.50) METMEN1KMT2ACHEK1NEK2
SCHEMBL3099091 0.82 MET (0.55) METMEN1KMT2ACHEK1NEK2
SCHEMBL3092070 0.82 MET (0.66) METMEN1KMT2ACHEK1NEK2
SCHEMBL2468762 0.81 MEN1 (0.57) MEN1KMT2ACHEK1NEK2LIMK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8173653-B2 Pyridiazinone derivatives for the treatment of tumours MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 2012-05-08 — — US claimed
EP-1960370-B1 PYRIDIAZINONE DERIVATIVES FOR TUMOUR TREATMENT MERCK PATENT GMBH (DE) 2011-10-05 — — EP claimed
US-20080293719-A1 Pyridiazinone Derivatives for the Treatment of Tumours MERCK PATENT GESELLSCHAFT (DE) 2008-11-27 — — US claimed
EP-1960370-A1 PYRIDIAZINONE DERIVATIVES FOR TUMOUR TREATMENT Merck Patent GmbH (DE) 2008-08-27 — — EP claimed
WO-2007065518-A1 PYRIDIAZINONE DERIVATIVES FOR TUMOUR TREATMENT MERCK PATENT GMBH (DE) 2007-06-14 — — WO claimed
EP-1960370-B1 PYRIDIAZINONE DERIVATIVES FOR TUMOUR TREATMENT MERCK PATENT GMBH (DE) 2011-10-05 — — EP 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-20080293719-A1 Pyridiazinone Derivatives for the Treatment of Tumours MET, RET, ERBB2 MET 1/4885MEN1 167/4885KMT2A 839/4885

“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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