SCHEMBL1750562

SCHEMBL1750562

O=C(O)c1ccc(OCCC2CC2)c(F)c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
MAPK1 P28482 1/20 0.53
HTT P42858 1/20 0.53
RAB9A P51151 1/20 0.53
SCN9A Q15858 2/20 0.48
HPGD P15428 1/20 0.44
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
MRGPRX4 Q96LA9 3/20 0.43
FFAR4 Q5NUL3 1/20 0.42
FABP3 P05413 1/20 0.41
FABP4 P15090 1/20 0.41
FABP5 Q01469 1/20 0.41
PLA2G2D Q9UNK4 1/20 0.41

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
SCHEMBL15968784 0.85 LMNA (0.55) LMNAMAPK1HTTRAB9AMRGPRX4
SCHEMBL9623610 0.85 LMNA (0.66) LMNAMAPK1HTTRAB9AHPGD
SCHEMBL24815311 0.82 TSHR (0.62) HTTMRGPRX4
SCHEMBL926838 0.80 LMNA (0.60) LMNAMAPK1HTTRAB9AHPGD
SCHEMBL25317057 0.80 LMNA (0.60) LMNAMAPK1HTTRAB9ATHRA
SCHEMBL10148081 0.80 MAP4K4 (0.54) LMNAMAPK1HTTRAB9AMRGPRX4
SCHEMBL24214170 0.79 LMNA (0.55) LMNAMAPK1HTTRAB9ATHRA
SCHEMBL1470380 0.79 LMNA (0.63) LMNAMAPK1HTTRAB9AHPGD
SCHEMBL15067061 0.79 LMNA (0.58) LMNAMAPK1HTTRAB9ATHRA
SCHEMBL24214163 0.78 LMNA (0.54) LMNAMAPK1HTTRAB9AHPGD

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
US-7968550-B2 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2011-06-28 US disclosed
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-09-06 US disclosed
US-7223788-B2 therapy for eating disorders, anorexigenic agents, antidiabetic agents, reducing weight in mammals, circadian rhythm disease, psychological disorders SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-05-29 US disclosed
EP-1597228-A2 SUBSTITUTED N-ARYLHETEROCYCLES, METHOD FOR PRODUCTION AND USE THEREOF AS MEDICAMENTS Sanofi-Aventis Deutschland GmbH (DE) 2005-11-23 EP disclosed
US-20040220191-A1 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-11-04 US disclosed
WO-2004072025-A2 SUBSTITUTED N-ARYLHETEROCYCLES, METHOD FOR PRODUCTION AND USE THEREOF AS MEDICAMENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-08-26 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 (2 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-20040220191-A1 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments CYP11B2, CYP11B1, CYP1A1 LMNA 2677/4885MAPK1 496/4885HTT 1929/4885
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments CYP11B2, CYP11B1, NQO1 LMNA 2573/4885MAPK1 745/4885HTT 1798/4885

“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.