SCHEMBL1807244

SCHEMBL1807244

O=C(c1ccc2cccc(O)c2n1)N1CC(Oc2ccc(Cl)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.47
KDM4E B2RXH2 1/20 0.45
KMT2A Q03164 1/20 0.45
SCD O00767 2/20 0.42
PDE4D Q08499 2/20 0.41
METAP1 P53582 1/20 0.41
SCD5 Q86SK9 1/20 0.39
RBP4 P02753 1/20 0.39
PKLR P30613 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
SCN9A Q15858 3/20 0.36
SPR P35270 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
SCHEMBL1811562 0.92 SPR (0.46) PIM1KDM4EKMT2APDE4DMETAP1
SCHEMBL1807905 0.89 PIM1 (0.45) PIM1KDM4EKMT2APDE4DSCD5
SCHEMBL12188557 0.79 PIM1 (0.49) PIM1KDM4EKMT2APDE4DSCD5
SCHEMBL1807760 0.79 EPHX2 (0.47) PIM1KDM4EKMT2APDE4DSCD5
SCHEMBL1810159 0.79 SCD5 (0.54) PIM1KDM4EKMT2ASCDPDE4D
SCHEMBL1809321 0.78 HRH3 (0.47) PIM1KDM4EKMT2APDE4DSCD5
SCHEMBL1807405 0.78 PIM1 (0.45) PIM1KDM4EKMT2APDE4DSCD5
SCHEMBL1810506 0.76 HCRTR1 (0.51) RBP4PKLRALDH1A1GAA
SCHEMBL1810365 0.76 PRKAA2 (0.48) SCN9A
SCHEMBL1807201 0.76 HRH3 (0.47) KMT2APDE4DSCD5GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120232052-A1 ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-09-13 US claimed
WO-2011058766-A1 ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2011-05-19 WO claimed
US-9051296-B2 Aryl carboxamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2015-06-09 US disclosed
US-9051296-B2 Aryl carboxamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2015-06-09 US disclosed
US-9051296-B2 Aryl carboxamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2015-06-09 US disclosed
US-20120232052-A1 ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-09-13 US disclosed
WO-2011058766-A1 ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2011-05-19 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-20120232052-A1 ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS SCN1B, SCN1A, SCN2B PIM1 4238/4885KDM4E 1141/4885KMT2A 1032/4885

“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.