SCHEMBL2300949

SCHEMBL2300949

Fc1c(OC2C[N]C2)cccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
SCN9A Q15858 1/20 0.38
SCD O00767 3/20 0.38
AURKA O14965 6/20 0.37
AURKB Q96GD4 5/20 0.37
INCENP Q9NQS7 5/20 0.37
TYRO3 Q06418 3/20 0.36
KDM1A O60341 1/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
MPL P40238 1/20 0.34

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
SCHEMBL2298452 0.85 SCD (0.49) SCDCYP3A4CYP2D6
SCHEMBL14957434 0.81 SLC6A2 (0.66) SLC6A2SLC6A4SLC6A3
SCHEMBL3117365 0.80 SLC6A2 (0.64) SLC6A2SLC6A4SLC6A3
SCHEMBL28468855 0.73 IDO1 (0.41) MPL
SCHEMBL2300625 0.72 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3
SCHEMBL2301366 0.71 PDE3B (0.40) SLC6A2SLC6A4SLC6A3SCN9A
SCHEMBL3512541 0.71 RBP4 (0.49) SCDCYP2D6
SCHEMBL2297472 0.70 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3SCN9A
SCHEMBL4511619 0.70 AR (0.44) CYP3A4CYP2D6
SCHEMBL3118290 0.69 SCD (0.53) SCDCYP3A4CYP2D6

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-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

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 SLC6A2 475/4885SLC6A4 502/4885SLC6A3 1199/4885

“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.