SCHEMBL23638875

SCHEMBL23638875

CCN(CC)[C@H]1C[C@@H](c2cccc(C(F)(F)F)c2)CC[C@@H]1OC(C)C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.46
HTR2C P28335 3/20 0.41
SCN9A Q15858 5/20 0.39
TACR1 P25103 1/20 0.37
KDM1A O60341 1/20 0.37
RCOR1 Q9UKL0 1/20 0.37
HTR2B P41595 2/20 0.37
CHRM2 P08172 1/20 0.37
HTR1A P08908 1/20 0.37
DRD3 P35462 1/20 0.37
HTR2A P28223 1/20 0.37

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
SCHEMBL23638878 0.90 DRD2 (0.43) DRD2HTR2CSCN9AKDM1ARCOR1
SCHEMBL20063500 0.89 SCN9A (0.47) DRD2HTR2CSCN9AHTR2BHTR2A
SCHEMBL23639055 0.85 SCN9A (0.43) DRD2HTR2CSCN9A
SCHEMBL23140999 0.81 DRD2 (0.51) DRD2HTR2CSCN9AKDM1ARCOR1
SCHEMBL23140860 0.81 DRD2 (0.51) DRD2HTR2CSCN9AKDM1ARCOR1
SCHEMBL23638950 0.76 SCN9A (0.48) DRD2HTR2CSCN9AHTR2BCHRM2
SCHEMBL23639026 0.75 SCN9A (0.47) DRD2HTR2CSCN9AHTR2BCHRM2
SCHEMBL23638885 0.75 SCN9A (0.42) DRD2SCN9ATACR1HTR1ADRD3
SCHEMBL23638881 0.74 SCN9A (0.35) SCN9ATACR1
SCHEMBL23638947 0.73 SCN9A (0.48) SCN9A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210214336-A1 PYRIDINE-SULFONAMIDE DERIVATIVES AS SODIUM CHANNEL INHIBITORS GENENTECH, INC. (US) 2021-07-15 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-20210214336-A1 PYRIDINE-SULFONAMIDE DERIVATIVES AS SODIUM CHANNEL INHIBITORS SCN1B, CACNA1A, SCN1A DRD2 1985/4885HTR2C 1563/4885SCN9A 34/4885

“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.