SCHEMBL2300932

SCHEMBL2300932

Fc1cc(OC2CC[N]CC2)ccc1OC(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.42
MCHR1 Q99705 1/20 0.40
SLC7A5 Q01650 1/20 0.40
EPHX2 P34913 6/20 0.38
FPR2 P25090 3/20 0.37
PROKR1 Q8TCW9 3/20 0.37
PDE2A O00408 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
CTSK P43235 1/20 0.34
NAAA Q02083 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
P2RX7 Q99572 1/20 0.34
GPR6 P46095 1/20 0.33

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
SCHEMBL2302138 0.89 SCN9A (0.41) SCN9AEPHX2PTGS1PTGS2
SCHEMBL3120075 0.85 EPHX2 (0.40) SCN9AMCHR1SLC7A5EPHX2FPR2
SCHEMBL3121175 0.83 HRH1 (0.45) SCN9AMCHR1
SCHEMBL2301156 0.82 SCN9A (0.42) SCN9AEPHX2FPR2PROKR1PDE3A
SCHEMBL3125948 0.80 PTGS1 (0.41) FPR2PROKR1PTGS1PTGS2
SCHEMBL2298969 0.80 EPHX2 (0.45) EPHX2FPR2PROKR1
SCHEMBL3122000 0.79 SLC6A4 (0.48)
SCHEMBL26933620 0.78 SLC7A5 (0.41) SCN9AMCHR1SLC7A5EPHX2PDE2A
SCHEMBL26933615 0.78 SLC7A5 (0.41) SCN9AMCHR1SLC7A5EPHX2PDE2A
SCHEMBL2296998 0.78 MGLL (0.44) SCN9AEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9334269-B2 Carboxamides as inhibitors of voltage-gated sodium channels AMGEN INC. (US) 2016-05-10 US disclosed
US-20130131035-A1 CARBOXAMIDES AS INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS AMGEN INC. (US) 2013-05-23 US disclosed
EP-2536689-A1 ARYL CARBOXAMIDE DERIVATIVES AS SODIUM CHANNEL INHIBITORS FOR TREATMENT OF PAIN Amgen Inc. (US) 2012-12-26 EP disclosed
WO-2011103196-A1 ARYL CARBOXAMIDE DERIVATIVES AS SODIUM CHANNEL INHIBITORS FOR TREATMENT OF PAIN AMGEN INC. (US) 2011-08-25 WO disclosed
WO-2010022055-A2 INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS AMGEN INC. (US) 2010-02-25 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-20130131035-A1 CARBOXAMIDES AS INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS CACNA1B, SCN1A, CACNA1I SCN9A 18/4885MCHR1 4350/4885SLC7A5 2597/4885

“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.