SCHEMBL4007944

SCHEMBL4007944

CCOC(=O)C(C)Oc1ccc(C(F)(F)F)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 8/20 0.51
PTGDR2 Q9Y5Y4 3/20 0.50
FFAR1 O14842 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
PPOX P50336 1/20 0.45
PPARD Q03181 1/20 0.45
PPARA Q07869 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
PDE2A O00408 1/20 0.44

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
SCHEMBL10963334 0.88 FFAR1 (0.58) MRGPRX4PTGDR2FFAR1PPOXPPARD
SCHEMBL9811752 0.87 MRGPRX4 (0.48) MRGPRX4PTGDR2FFAR1
SCHEMBL9714362 0.86 FFAR1 (0.54) MRGPRX4PTGDR2FFAR1PPOXPPARD
SCHEMBL11119306 0.86 FFAR1 (0.51) MRGPRX4FFAR1PPOXMEN1KMT2A
SCHEMBL11262624 0.86 FFAR1 (0.51) MRGPRX4PTGDR2FFAR1PPOXPPARD
SCHEMBL11433088 0.85 FFAR1 (0.50) MRGPRX4PTGDR2FFAR1PPOXPPARD
SCHEMBL10644204 0.84 FFAR1 (0.52) MRGPRX4PTGDR2FFAR1PPOXPPARD
SCHEMBL9633459 0.84 FFAR1 (0.52) MRGPRX4PTGDR2FFAR1PPOXPPARD
SCHEMBL9507156 0.84 FFAR1 (0.49) MRGPRX4PTGDR2FFAR1PPOXPPARD
SCHEMBL9503637 0.84 MEN1 (0.53) MRGPRX4PTGDR2FFAR1PPOXPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1558567-B1 NOVEL AMIDE COMPOUNDS WITH MCH ANTAGONISTIC EFFECT AND MEDICAMENTS COMPRISING SAID COMPOUNDS BOEHRINGER INGELHEIM PHARMA (DE) 2009-06-24 EP disclosed
US-7351719-B2 Amide compounds having MCH-antagonistic activity and medicaments comprising these compounds BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2008-04-01 US disclosed
EP-1558567-A1 NOVEL AMIDE COMPOUNDS WITH MCH ANTAGONISTIC EFFECT AND MEDICAMENTS COMPRISING SAID COMPOUNDS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-08-03 EP disclosed
US-20040152742-A1 Amide compounds having MCH-antagonistic activity and medicaments comprising these compounds BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-08-05 US disclosed
WO-2004039764-A1 NOVEL AMIDE COMPOUNDS WITH MCH ANTAGONISTIC EFFECT AND MEDICAMENTS COMPRISING SAID COMPOUNDS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-05-13 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-20040152742-A1 Amide compounds having MCH-antagonistic activity and medicaments comprising these compounds MCHR2, MCHR1, NPY1R MRGPRX4 45/4885PTGDR2 708/4885FFAR1 140/4885

“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.