SCHEMBL2297752

SCHEMBL2297752

FC(F)(F)Oc1ccc(OCC2C[N]C2)cc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.43
KDM1A O60341 2/20 0.43
DRD4 P21917 1/20 0.40
AOC3 Q16853 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
CHRNA7 P36544 1/20 0.38
NISCH Q9Y2I1 1/20 0.37
FFAR4 Q5NUL3 4/20 0.37
RCOR1 Q9UKL0 1/20 0.37
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
SLC6A4 P31645 1/20 0.36
SCN9A Q15858 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
SCHEMBL2300796 0.84 ALDH1A1 (0.42) ALDH1A1TSHRSCN9A
SCHEMBL2299932 0.83 LTA4H (0.47) MAOBKDM1AAOC3CHRNA7ALDH1A1
SCHEMBL2298055 0.80 DRD4 (0.43) DRD4
SCHEMBL14312078 0.79 MAOB (0.46) MAOBKDM1ADRD4AOC3L3MBTL1
SCHEMBL2298890 0.77 TDP1 (0.57) KDM1ADRD4
SCHEMBL2297872 0.77 LTA4H (0.44)
SCHEMBL2298798 0.75 SIGMAR1 (0.54) MAOBKDM1ASLC6A4
SCHEMBL7968648 0.74 ALDH1A1 (0.60) MAOBKDM1ADRD4AOC3L3MBTL1
SCHEMBL7968652 0.74 ALDH1A1 (0.60) MAOBKDM1ADRD4AOC3L3MBTL1
SCHEMBL1227958 0.74 ALDH1A1 (0.60) MAOBKDM1ADRD4AOC3L3MBTL1

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 MAOB 2676/4885KDM1A 748/4885DRD4 3047/4885

“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.