SCHEMBL2064811

SCHEMBL2064811

Cc1cccc(NC(=O)c2cncc(Cl)n2)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN2A Q99250 4/20 0.70
▸ SCN10A Q9Y5Y9 4/20 0.70
▸ SMN1; SMN2 Q16637 3/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ LMNA P02545 2/20 0.59
▸ ALDH1A1 P00352 1/20 0.59
▸ CSF1R P07333 4/20 0.56
▸ RET P07949 1/20 0.56
▸ PDGFRB P09619 1/20 0.56
▸ KIT P10721 1/20 0.56
▸ SRC P12931 1/20 0.56
▸ PDGFRA P16234 1/20 0.56
▸ FLT1 P17948 1/20 0.56
▸ FLT4 P35916 1/20 0.56
▸ KDR P35968 1/20 0.56
▸ FRK P42685 1/20 0.56
▸ DDR1 Q08345 1/20 0.56
▸ GAA P10253 1/20 0.55
▸ RXFP1 Q9HBX9 1/20 0.54

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
SCHEMBL28491336 0.86 SMN1; SMN2 (0.58) SCN2ASCN10ASMN1; SMN2MEN1KMT2A
SCHEMBL23413329 0.82 GAA (0.60) SCN2ASCN10ASMN1; SMN2MEN1KMT2A
SCHEMBL30097611 0.82 GAA (0.60) SCN2ASCN10ASMN1; SMN2MEN1KMT2A
SCHEMBL1134481 0.82 SCN2A (0.64) SCN2ASCN10ASMN1; SMN2CSF1RRET
SCHEMBL259290 0.79 RAB9A (0.69) SCN2ASCN10ASMN1; SMN2MEN1KMT2A
SCHEMBL3104769 0.76 SCN2A (0.57) SCN2ASCN10ASMN1; SMN2MEN1KMT2A
SCHEMBL259296 0.75 KMT2A (0.80) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL30184168 0.75 GAA (0.55) SCN2ASCN10ASMN1; SMN2MEN1KMT2A
SCHEMBL25218898 0.75 GAA (0.55) SCN2ASCN10ASMN1; SMN2MEN1KMT2A
SCHEMBL259371 0.75 KMT2A (0.66) SMN1; SMN2MEN1KMT2ALMNAALDH1A1

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-2700639-A1 Selective ligands for the neuronal nicotinic receptors and uses thereof Abbvie Inc. (US) 2014-02-26 — — EP disclosed
US-8648084-B2 Selective substituted pyrazine ligands for neuronal nicotinic receptors ABBVIE INC. (US) 2014-02-11 — — US disclosed
US-20120190692-A1 SELECTIVE SUBSTITUTED PYRIDINE LIGANDS FOR NEURONAL NICOTINIC RECEPTORS ABBVIE INC. 2012-07-26 — — US disclosed
US-8148408-B2 Selective substituted pyridine ligands for neuronal nicotinic receptors ABBOTT LABORATORIES (US) 2012-04-03 — — US disclosed
US-20090281118-A1 Selective Ligands for the Neuronal Nicotinic Receptors and Uses Thereof ABBOTT LABORATORIES (US) 2009-11-12 — — 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-20120190692-A1 SELECTIVE SUBSTITUTED PYRIDINE LIGANDS FOR NEURONAL NICOTINIC RECEPTORS CHRNA4, CHRNB4, CHRNA2 SCN2A 106/4885SCN10A 152/4885SMN1; SMN2 306/4885
US-20090281118-A1 Selective Ligands for the Neuronal Nicotinic Receptors and Uses Thereof CHRNA4, CHRNB4, CHRNA2 SCN2A 113/4885SCN10A 139/4885SMN1; SMN2 310/4885

“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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