SCHEMBL2300752

SCHEMBL2300752

Fc1cc(OC2C[N]C2)ccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 5/20 0.45
SLC6A2 P23975 2/20 0.45
SLC6A3 Q01959 2/20 0.45
FPR2 P25090 2/20 0.44
PROKR1 Q8TCW9 2/20 0.44
CHRNA3 P32297 1/20 0.38
SCN9A Q15858 3/20 0.36
ATF4 P18848 2/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
TRPV4 Q9HBA0 1/20 0.35
HTR2A P28223 2/20 0.35
KCNH2 Q12809 2/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL2297195 0.86 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3SCN9ATRPV4
SCHEMBL2300977 0.84 SLC6A4 (0.62) SLC6A4SLC6A2SLC6A3FPR2PROKR1
SCHEMBL2296925 0.84 GRIN1 (0.39) SLC6A4SLC6A2SLC6A3SCN9APTGS1
SCHEMBL2300778 0.83 FPR2 (0.48) SLC6A4SLC6A2SLC6A3FPR2PROKR1
SCHEMBL2299212 0.79 SLC6A2 (0.45) SLC6A4SLC6A2SLC6A3FPR2PROKR1
SCHEMBL3128358 0.79 FFAR4 (0.38) SLC6A4SLC6A2SLC6A3FPR2PROKR1
SCHEMBL14956384 0.79 SLC6A2 (0.72) SLC6A4SLC6A2SLC6A3FPR2PROKR1
SCHEMBL2298197 0.77 SLC6A2 (0.50) SLC6A4SLC6A2SLC6A3FPR2PROKR1
SCHEMBL3126426 0.76 HCRTR1 (0.42) SLC6A4FPR2PROKR1SCN9AHTR2A
SCHEMBL2301306 0.76 PARP10 (0.42) SLC6A4SLC6A2SLC6A3SCN9AATF4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010022055-A2 INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS AMGEN INC. (US) 2010-02-25 WO claimed
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 SLC6A4 502/4885SLC6A2 475/4885SLC6A3 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.