SCHEMBL2299164

SCHEMBL2299164

Fc1ccc(F)c(OC2C[N]C2)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.37
SLC6A3 Q01959 3/20 0.37
HTR1A P08908 2/20 0.37
SCD O00767 2/20 0.35
SLC6A4 P31645 3/20 0.35
KDM1A O60341 2/20 0.34
KDM1B Q8NB78 1/20 0.34
TYRO3 Q06418 1/20 0.34
SCN9A Q15858 1/20 0.34
CA3 P07451 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
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
SCHEMBL2299176 0.85 GRIN1 (0.40) GPR6
SCHEMBL2299385 0.82 SYK (0.40) SLC6A2SLC6A3HTR1ASLC6A4SCN9A
SCHEMBL2300625 0.81 SLC6A2 (0.50) SLC6A2SLC6A3HTR1ASLC6A4
SCHEMBL20064064 0.79 FFAR4 (0.45) SLC6A2SLC6A3HTR1ASCDTYRO3
SCHEMBL2303839 0.79 OXTR (0.42) SLC6A2SLC6A3SCDSLC6A4SCN9A
SCHEMBL14957010 0.78 SLC6A2 (0.60) SLC6A2SLC6A3HTR1ASLC6A4
SCHEMBL2297472 0.76 SLC6A2 (0.43) SLC6A2SLC6A3HTR1ASLC6A4SCN9A
SCHEMBL2299025 0.75 FPR2 (0.44) SLC6A4GPR6
SCHEMBL83203 0.75 SLC6A2 (0.62) SLC6A2SLC6A3HTR1ASLC6A4
SCHEMBL3514516 0.75 RBP4 (0.52) SLC6A4

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 SLC6A2 475/4885SLC6A3 1199/4885HTR1A 391/4885

“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.