SCHEMBL486183

SCHEMBL486183

CC(C)(C)n1nccc1-c1cc(F)ccc1Br

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 6/20 0.44
DRD1 P21728 2/20 0.36
GAA P10253 1/20 0.31
P2RY6 Q15077 1/20 0.31
DPP4 P27487 1/20 0.31
KDM4A O75164 1/20 0.30
KDM5A P29375 1/20 0.30
KDM4C Q9H3R0 1/20 0.30
KDM5B Q9UGL1 1/20 0.30

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
SCHEMBL12869875 0.83 SCN9A (0.38) SCN9ADRD1
SCHEMBL25144315 0.78 SCN9A (0.42) SCN9ADRD1
SCHEMBL486085 0.74 DRD1 (0.39) SCN9ADRD1KDM4AKDM5AKDM4C
SCHEMBL19205767 0.74 DRD1 (0.47) SCN9ADRD1KDM5AKDM4CKDM5B
SCHEMBL12869815 0.74 DRD1 (0.38) SCN9ADRD1GAA
SCHEMBL486086 0.72 GAA (0.34) GAA
SCHEMBL20548183 0.70 SCN9A (0.37) SCN9ADRD1
SCHEMBL486019 0.70 GAA (0.32) GAA
SCHEMBL13189635 0.69 HTR2A (0.33)
SCHEMBL27693599 0.66 CA3 (0.37) SCN9AKDM4AKDM5AKDM4CKDM5B

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
EP-2411388-A2 PROCESS FOR THE PRODUCTION OF FUSED, TRICYCLIC SULFONAMIDES Elan Pharmaceuticals Inc. (US) 2012-02-01 EP disclosed
US-20110034691-A1 Process for the Production of Fused, Tricyclic Sulfonamides ELAN PHARMACEUTICALS, INC. 2011-02-10 US disclosed
US-20110034691-A1 Process for the Production of Fused, Tricyclic Sulfonamides ELAN PHARMACEUTICALS, INC. 2011-02-10 US disclosed
US-20110034691-A1 Process for the Production of Fused, Tricyclic Sulfonamides ELAN PHARMACEUTICALS, INC. 2011-02-10 US disclosed
WO-2010111418-A2 PROCESS FOR THE PRODUCTION OF FUSED, TRICYCLIC SULFONAMIDES ELAN PHARMACEUTICALS, INC. (US) 2010-09-30 WO disclosed
WO-2010111418-A2 PROCESS FOR THE PRODUCTION OF FUSED, TRICYCLIC SULFONAMIDES ELAN PHARMACEUTICALS, INC. (US) 2010-09-30 WO 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-20110034691-A1 Process for the Production of Fused, Tricyclic Sulfonamides CBR3, DRD4, SBDS SCN9A 1991/4885DRD1 10/4885GAA 1643/4885

“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.