SCHEMBL2064201

SCHEMBL2064201

Cc1cccc(NC(=O)c2cncc(N3CC4CCN(C(=O)OC(C)(C)C)C4C3)n2)c1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN2A Q99250 3/20 0.43
SCN10A Q9Y5Y9 3/20 0.43
GPR119 Q8TDV5 1/20 0.42
USP30 Q70CQ3 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
RET P07949 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
SCHEMBL2064202 1.00 SCN2A (0.43) SCN2ASCN10AGPR119USP30KMT2A
SCHEMBL2065435 0.87 SCN2A (0.47) SCN2ASCN10AGPR119KMT2ALMNA
SCHEMBL2065436 0.87 SCN2A (0.47) SCN2ASCN10AGPR119KMT2ALMNA
SCHEMBL2065334 0.81 SCN10A (0.44) SCN2ASCN10A
SCHEMBL2065335 0.81 SCN10A (0.44) SCN2ASCN10A
SCHEMBL2065523 0.79 USP30 (0.43) SCN2ASCN10AUSP30
SCHEMBL2065525 0.79 USP30 (0.43) SCN2ASCN10AUSP30
SCHEMBL1135346 0.79 SCN2A (0.52) SCN2ASCN10A
SCHEMBL2064240 0.78 SCN10A (0.43) SCN2ASCN10AGPR119KMT2AMAPT
SCHEMBL2064242 0.78 SCN10A (0.43) SCN2ASCN10AGPR119KMT2AMAPT

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 152/4885GPR119 102/4885
US-20090281118-A1 Selective Ligands for the Neuronal Nicotinic Receptors and Uses Thereof CHRNA4, CHRNB4, CHRNA2 SCN2A 113/4885SCN10A 139/4885GPR119 76/4885

“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.