SCHEMBL3065115

SCHEMBL3065115

CCN(CC)c1nc(CN(C(=O)C(C)(C)C)c2ccc(F)cc2)cs1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 16/20 0.42
GRIN2A Q12879 16/20 0.42
GRIA2 P42262 12/20 0.42
GRM1 Q13255 1/20 0.37
NPC1 O15118 1/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL3068329 0.91 GRIN2A (0.39) GRIN1GRIN2AGRIA2GRM1
SCHEMBL3055945 0.88 MEN1 (0.41) GRIN1GRIN2AGRIA2GRM1NPC1
SCHEMBL3063760 0.87 GRM1 (0.37) GRM1NPC1CASP3RAB9ASENP8
SCHEMBL3063987 0.87 GRIN1 (0.43) GRIN1GRIN2AGRIA2GRM1
SCHEMBL3059140 0.87 MEN1 (0.45) GRM1NPC1CASP3RAB9ASENP8
SCHEMBL3064059 0.85 GRM1 (0.34) GRIN1GRIN2AGRIA2GRM1NPC1
SCHEMBL3068075 0.84 MAPT (0.35) GRM1NPC1CASP3RAB9ASENP8
SCHEMBL8173447 0.84 NPC1 (0.42) GRM1NPC1CASP3RAB9ASENP8
SCHEMBL3058858 0.84 MEN1 (0.44) GRM1NPC1CASP3RAB9ASENP8
SCHEMBL3071290 0.83 SMN1; SMN2 (0.38) GRIN1GRIN2AGRIA2NPC1CASP3

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-20100267697-A1 ION CHANNEL MODULATORS WYETH (US) 2010-10-21 US claimed
EP-2099754-A1 ION CHANNEL MODULATORS Wyeth a Corporation of the State of Delaware (US) 2009-09-16 EP claimed
WO-2008073929-A1 ION CHANNEL MODULATORS WYETH (US) 2008-06-19 WO claimed
US-20100267697-A1 ION CHANNEL MODULATORS WYETH (US) 2010-10-21 US disclosed
US-20100267697-A1 ION CHANNEL MODULATORS WYETH (US) 2010-10-21 US disclosed
US-20100267697-A1 ION CHANNEL MODULATORS WYETH (US) 2010-10-21 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 (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-20100267697-A1 ION CHANNEL MODULATORS CACNA1E, CACNA1A, CACNA1S GRIN1 165/4885GRIN2A 161/4885GRIA2 253/4885

“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.