SCHEMBL2642593

SCHEMBL2642593

Cc1ccncc1Sc1ccc(Sc2nnc[nH]2)nc1C(=O)Nc1nccs1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GCK P35557 11/20 0.52
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
PPARG P37231 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL2642523 0.88 GCK (0.54) GCKRAB9ANPC1L3MBTL1SMN1; SMN2
SCHEMBL2208913 0.87 GCK (0.62) GCKRAB9ANPC1L3MBTL1SMN1; SMN2
SCHEMBL2208920 0.85 GCK (0.61) GCKRAB9ANPC1L3MBTL1SMN1; SMN2
SCHEMBL2216723 0.85 GCK (0.60) GCKRAB9ANPC1L3MBTL1SMN1; SMN2
SCHEMBL2212891 0.85 GCK (0.57) GCKRAB9ANPC1L3MBTL1POLB
SCHEMBL2212557 0.83 GCK (0.73) GCKRAB9ANPC1L3MBTL1POLB
SCHEMBL2211366 0.83 GCK (0.74) GCKRAB9ANPC1L3MBTL1SMN1; SMN2
SCHEMBL2213136 0.82 GCK (0.56) GCKRAB9ANPC1L3MBTL1SMN1; SMN2
SCHEMBL2208883 0.82 GCK (0.57) GCKL3MBTL1
SCHEMBL2215188 0.82 GCK (0.59) GCKRAB9ANPC1L3MBTL1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8765789-B2 2-pyridinecarboxamide derivatives MSD K.K. (JP) 2014-07-01 US disclosed
US-20130085156-A1 NOVEL 2-PYRIDINECARBOXAMIDE DERIVATIVES MSD K.K. (JP) 2013-04-04 US disclosed
US-8344003-B2 2-pyridinecarboxamide derivatives MSD K. K. (JP) 2013-01-01 US disclosed
US-20100041660-A1 NOVEL 2-PYRIDINECARBOXAMIDE DERIVATIVES MSD K.K. (JP) 2010-02-18 US disclosed
US-7629362-B2 2-pyridine carboxamide derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-12-08 US disclosed
US-20060258701-A1 Novel 2-pyridinecarboxamide derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-16 US disclosed
EP-1598349-A1 NOVEL 2-PYRIDINECARBOXAMIDE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-11-23 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 (3 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-20130085156-A1 NOVEL 2-PYRIDINECARBOXAMIDE DERIVATIVES GCKR, GCK, HK2 GCK 2/4885RAB9A 3609/4885NPC1 4261/4885
US-20060258701-A1 Novel 2-pyridinecarboxamide derivatives GCKR, GCK, HK2 GCK 2/4885RAB9A 3535/4885NPC1 4274/4885
US-20100041660-A1 NOVEL 2-PYRIDINECARBOXAMIDE DERIVATIVES GCKR, GCK, HK2 GCK 2/4885RAB9A 3609/4885NPC1 4261/4885

“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.