SCHEMBL31433447

SCHEMBL31433447

CC(C)(C)OC(=O)N[C@H]1CC[C@H](c2cccc(OC(F)(F)F)c2)C[C@@H]1N1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 6/20 0.51
HCRTR2 O43614 4/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
TAS1R2 Q8TE23 1/20 0.43
DPP4 P27487 1/20 0.41
KDM1A O60341 2/20 0.38
MAOB P27338 1/20 0.38
BCL9 O00512 2/20 0.37
CTNNB1 P35222 2/20 0.37
MGLL Q99685 1/20 0.36
NOTUM Q6P988 1/20 0.36
CHRNA7 P36544 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
SCHEMBL23639065 1.00 SCN9A (0.51) SCN9AHCRTR2TAS1R3TAS1R1TAS1R2
SCHEMBL23141079 0.88 SCN9A (0.53) SCN9AHCRTR2TAS1R3TAS1R1TAS1R2
SCHEMBL20073015 0.87 SCN9A (0.49) SCN9AHCRTR2TAS1R3TAS1R1TAS1R2
SCHEMBL20063933 0.87 SCN9A (0.49) SCN9AHCRTR2TAS1R3TAS1R1TAS1R2
SCHEMBL21306610 0.87 SCN9A (0.49) SCN9AHCRTR2TAS1R3TAS1R1TAS1R2
SCHEMBL23639040 0.84 TAS1R3 (0.44) SCN9AHCRTR2TAS1R3TAS1R1TAS1R2
SCHEMBL31433355 0.84 TAS1R3 (0.44) SCN9AHCRTR2TAS1R3TAS1R1TAS1R2
SCHEMBL23638941 0.82 SCN9A (0.52) SCN9AHCRTR2DPP4BCL9CTNNB1
SCHEMBL23140784 0.78 SCN9A (0.47) SCN9AHCRTR2MGLLNOTUM
SCHEMBL21384745 0.74 PDE4B (0.53) BCL9CTNNB1MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250115576-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2025-04-10 US disclosed
US-12209075-B2 Pyridine-sulfonamide derivatives as sodium channel inhibitors GENENTECH, INC. (US) 2025-01-28 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-12209075-B2 Pyridine-sulfonamide derivatives as sodium channel inhibitors SCN1B, CACNA1A, SCN1A SCN9A 36/4885HCRTR2 1445/4885TAS1R3 254/4885
US-20250115576-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF F12, REN, ZYX SCN9A 1485/4885HCRTR2 252/4885TAS1R3 2698/4885

“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.