SCHEMBL1749245

SCHEMBL1749245

CCCOc1ccc(C(=O)Nc2ccc(N3CCC(N(C)C(C)=O)C3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 10/20 0.68
MAPT P10636 7/20 0.64
ALDH1A1 P00352 4/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
USP2 O75604 1/20 0.64
HIF1A Q16665 1/20 0.59
HSD17B10 Q99714 3/20 0.58
TSHR P16473 2/20 0.58
HPGD P15428 1/20 0.58
TAAR1 Q96RJ0 1/20 0.58
KMT2A Q03164 2/20 0.57
ALOX15 P16050 1/20 0.57
KDM4E B2RXH2 2/20 0.56
RAB9A P51151 1/20 0.56
MCL1 Q07820 1/20 0.56
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.53

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
SCHEMBL1749173 0.96 MCHR1 (0.68) MCHR1MAPTALDH1A1SMN1; SMN2USP2
SCHEMBL12529169 0.94 MCHR1 (0.66) MCHR1MAPTALDH1A1SMN1; SMN2USP2
SCHEMBL1749193 0.91 MCHR1 (0.66) MCHR1MAPTALDH1A1SMN1; SMN2USP2
SCHEMBL1749717 0.90 MCHR1 (0.77) MCHR1MAPTALDH1A1SMN1; SMN2USP2
SCHEMBL12529170 0.89 MCHR1 (0.64) MCHR1MAPTALDH1A1SMN1; SMN2USP2
SCHEMBL12529202 0.88 MCHR1 (0.67) MCHR1MAPTALDH1A1SMN1; SMN2USP2
SCHEMBL1748979 0.88 MCHR1 (0.67) MCHR1MAPTALDH1A1SMN1; SMN2USP2
SCHEMBL1749376 0.87 MCHR1 (0.55) MCHR1MAPTALDH1A1SMN1; SMN2USP2
SCHEMBL1749127 0.86 MCHR1 (0.73) MCHR1MAPTALDH1A1SMN1; SMN2USP2
SCHEMBL12529341 0.86 MAPT (0.58) MCHR1MAPTALDH1A1SMN1; SMN2USP2

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 9 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-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-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-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-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
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
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

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-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments CYP11B2, CYP11B1, NQO1 MCHR1 2068/4885MAPT 4800/4885ALDH1A1 374/4885

“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.