SCHEMBL3058445

SCHEMBL3058445

CCN(c1cccc(CN(C(=O)[C@@H]2CCCN2)c2ccc(F)cc2)c1)C1CC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 1/20 0.38
NR1H4 Q96RI1 7/20 0.38
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
CNR2 P34972 2/20 0.35
ALDH1A1 P00352 1/20 0.35
S1PR1 P21453 1/20 0.35
CNR1 P21554 1/20 0.35
ACHE P22303 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34

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
SCHEMBL3821794 0.81 OPRM1 (0.39) NR1H4ALDH1A1S1PR1ACHECHRM2
SCHEMBL3059109 0.80 ACHE (0.39) SLC6A2SLC6A4SLC6A3S1PR1ACHE
SCHEMBL8170417 0.80 CNR2 (0.55) SCN4ACNR2CNR1
Hydrochloric Acid SCHEMBL3064216 0.79 ACHE (0.39) SLC6A2SLC6A4SLC6A3S1PR1ACHE
SCHEMBL3819363 0.79 ATM (0.39) NR1H4SLC6A2SLC6A3S1PR1ACHE
SCHEMBL3064159 0.79 CHRM1 (0.42) NR1H4ACHECHRM2CHRM1CHRM3
SCHEMBL3053871 0.78 CNR2 (0.41) NR1H4CNR2CNR1CHRM2CHRM1
SCHEMBL4734946 0.78 LMNA (0.58) ALDH1A1
SCHEMBL4738981 0.77 LMNA (0.41) NR1H4S1PR1ACHECHRM2CHRM1
SCHEMBL3067558 0.77 ENPP2 (0.36) SCN4A

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 SCN4A 94/4885NR1H4 761/4885SLC6A2 645/4885

“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.