SCHEMBL29702247

SCHEMBL29702247

CCC1CN(Cc2ccccc2)CC(C(F)(F)F)O1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 0.42
DRD4 P21917 5/20 0.41
SIGMAR1 Q99720 2/20 0.41
DRD2 P14416 2/20 0.40
DRD3 P35462 2/20 0.40
ACHE P22303 2/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL21906181 1.00 FUCA1 (0.42) FUCA1DRD4SIGMAR1DRD2DRD3
SCHEMBL21192878 0.87 GBA1 (0.47) FUCA1DRD4SIGMAR1DRD2DRD3
SCHEMBL21193171 0.87 GBA1 (0.47) FUCA1DRD4SIGMAR1DRD2DRD3
SCHEMBL30613723 0.87 GBA1 (0.47) FUCA1DRD4SIGMAR1DRD2DRD3
SCHEMBL26130663 0.87 GBA1 (0.47) FUCA1DRD4SIGMAR1DRD2DRD3
SCHEMBL1591829 0.85 FUCA1 (0.51) FUCA1DRD4SIGMAR1DRD2DRD3
SCHEMBL1591825 0.85 FUCA1 (0.51) FUCA1DRD4SIGMAR1DRD2DRD3
SCHEMBL25111516 0.83 KDM4E (0.49) FUCA1ACHEKDM4E
SCHEMBL12703742 0.83 KDM4E (0.49) FUCA1ACHEKDM4E
SCHEMBL1592053 0.83 KDM4E (0.49) FUCA1ACHEKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250084064-A1 2-AMINO-N-HETEROARYL-NICOTINAMIDES AS NAV1.8 INHIBITORS MERCK SHARP & DOHME LLC (US) 2025-03-13 US disclosed
US-12195445-B2 2-amino-N-heteroaryl-nicotinamides as Nav1.8 inhibitors MERCK SHARP & DOHME LLC (US) 2025-01-14 US disclosed
US-20220289710-A1 2-AMINO-N-HETEROARYL-NICOTINAMIDES AS NAV1.8 INHIBITORS MERCK SHARP & DOHME LLC (US) 2022-09-15 US disclosed
US-11377438-B2 2-amino-n-heteroaryl-nicotinamides as Nav1.8 inhibitors MERCK SHARP & DOHME LLC (US) 2022-07-05 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 (4 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-12195445-B2 2-amino-N-heteroaryl-nicotinamides as Nav1.8 inhibitors SCN8A, SCN2A, SCN1A FUCA1 2747/4885DRD4 4508/4885SIGMAR1 2837/4885
US-20250084064-A1 2-AMINO-N-HETEROARYL-NICOTINAMIDES AS NAV1.8 INHIBITORS SCN8A, SCN2A, SCN1A FUCA1 2747/4885DRD4 4508/4885SIGMAR1 2837/4885
US-11377438-B2 2-amino-n-heteroaryl-nicotinamides as Nav1.8 inhibitors SCN8A, SCN2A, SCN1A FUCA1 2747/4885DRD4 4508/4885SIGMAR1 2837/4885
US-20220289710-A1 2-AMINO-N-HETEROARYL-NICOTINAMIDES AS NAV1.8 INHIBITORS SCN8A, SCN2A, SCN1A FUCA1 2747/4885DRD4 4508/4885SIGMAR1 2837/4885

“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.