SCHEMBL15873402

SCHEMBL15873402

O=C(O)N[C@H]1CCCN(c2cc(Cl)ncc2[N+](=O)[O-])C1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ POLB P06746 2/20 0.40
▸ MAPT P10636 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ LCK P06239 1/20 0.38
▸ JAK3 P52333 1/20 0.38
▸ BTK Q06187 1/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ CHRM4 P08173 9/20 0.38
▸ LMNA P02545 1/20 0.38

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
SCHEMBL15873401 1.00 MEN1 (0.40) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL13735271 0.88 MAPT (0.42) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL15887100 0.86 BTK (0.54) LCKJAK3BTK
SCHEMBL26632154 0.83 CHRM4 (0.41) MAPTALDH1A1CHRM4LMNA
SCHEMBL4443908 0.81 MAPT (0.46) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL15873245 0.81 MAPT (0.46) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL4444188 0.81 MAPT (0.46) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL15873243 0.81 MAPT (0.46) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL13736923 0.78 ALDH1A1 (0.46) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL15913876 0.78 ALDH1A1 (0.46) MEN1KMT2APOLBMAPTALDH1A1

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-2943485-B1 BICYCLIC AROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE HOLDINGS CORP (US) 2017-09-20 — — EP disclosed
US-9676750-B2 Bicyclic aromatic carboxamide compounds useful as pim kinase inhibitors INCYTE CORPORATION (US) 2017-06-13 — — US disclosed
US-20160137626-A1 BICYCLIC AROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE CORPORATION (US) 2016-05-19 — — US disclosed
US-9278950-B2 Bicyclic aromatic carboxamide compounds useful as Pim kinase inhibitors INCYTE CORPORATION (US) 2016-03-08 — — US disclosed
US-20140200216-A1 BICYCLIC AROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE CORPORATION (US) 2014-07-17 — — 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 (2 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-20160137626-A1 BICYCLIC AROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS PIM1, PIM2, PIM3 MEN1 4226/4885KMT2A 417/4885POLB 1432/4885
US-20140200216-A1 BICYCLIC AROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS PIM1, PIM2, PIM3 MEN1 4226/4885KMT2A 417/4885POLB 1432/4885

“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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