SCHEMBL6224275

SCHEMBL6224275

O=c1c2ccc(-c3ccc(C(F)(F)F)cc3)cc2ncn1CCc1ccc(CN2CCCC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHKA P35790 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ HRH3 Q9Y5N1 3/20 0.44
▸ ACHE P22303 1/20 0.43
▸ HTR1A P08908 1/20 0.42
▸ HTR7 P34969 1/20 0.42
▸ MCHR1 Q99705 3/20 0.42
▸ GRK2 P25098 2/20 0.41
▸ GRK1 Q15835 1/20 0.41
▸ DRD2 P14416 1/20 0.41
▸ DRD5 P21918 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ SIGMAR1 Q99720 1/20 0.41
▸ LSS P48449 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ CASP4 P49662 1/20 0.40
▸ CASP5 P51878 1/20 0.40
▸ QPCT Q16769 1/20 0.39
▸ QPCTL Q9NXS2 1/20 0.39

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
SCHEMBL6277525 0.89 MCHR1 (0.53) ALDH1A1HRH3ACHEHTR1AHTR7
SCHEMBL6223111 0.88 MCHR1 (0.50) KDM4EALDH1A1HRH3ACHEHTR1A
SCHEMBL6225277 0.87 MCHR1 (0.49) KDM4EALDH1A1HRH3ACHEHTR1A
SCHEMBL6223269 0.87 HRH3 (0.46) HRH3ACHEHTR1AHTR7MCHR1
SCHEMBL6225118 0.87 HRH3 (0.46) HRH3ACHEHTR1AHTR7MCHR1
SCHEMBL6222920 0.85 SCD (0.45) CHKAHRH3ACHEHTR1AHTR7
SCHEMBL6247232 0.85 P2RX3 (0.49) CHKAHRH3MCHR1
SCHEMBL6224826 0.81 CHKA (0.48) CHKAKDM4EALDH1A1HRH3MCHR1
SCHEMBL6226834 0.80 ROCK1 (0.51) HRH3MCHR1GRK2GRK1DRD2
SCHEMBL27629148 0.80 APP (0.42) GRK2GRK1DRD2DRD5DRD3

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
EP-1534689-A1 NOVEL CARBOXAMIDE COMPOUNDS HAVING AN MCH-ANTAGONISTIC EFFECT, MEDICAMENTS CONTAINING SAID COMPOUNDS, AND METHODS FOR THE PRODUCTION THEREOF BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-06-01 — — EP claimed
US-20040242572-A1 New carboxamide compounds having melanin concentrating hormone antagonistic activity, pharmaceutical preparations comprising these compounds and process for their manufacture BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2004-12-02 — — US claimed
WO-2004024702-A1 NOVEL CARBOXAMIDE COMPOUNDS HAVING AN MCH-ANTAGONISTIC EFFECT, MEDICAMENTS CONTAINING SAID COMPOUNDS, AND METHODS FOR THE PRODUCTION THEREOF BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-03-25 — — WO claimed
EP-1534689-A1 NOVEL CARBOXAMIDE COMPOUNDS HAVING AN MCH-ANTAGONISTIC EFFECT, MEDICAMENTS CONTAINING SAID COMPOUNDS, AND METHODS FOR THE PRODUCTION THEREOF BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-06-01 — — EP disclosed
US-20040242572-A1 New carboxamide compounds having melanin concentrating hormone antagonistic activity, pharmaceutical preparations comprising these compounds and process for their manufacture BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2004-12-02 — — US disclosed
WO-2004024702-A1 NOVEL CARBOXAMIDE COMPOUNDS HAVING AN MCH-ANTAGONISTIC EFFECT, MEDICAMENTS CONTAINING SAID COMPOUNDS, AND METHODS FOR THE PRODUCTION THEREOF BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-03-25 — — 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-20040242572-A1 New carboxamide compounds having melanin concentrating hormone antagonistic activity, pharmaceutical preparations comprising these compounds and process for their manufacture MCHR2, MCHR1, NPY1R CHKA 2359/4885KDM4E 492/4885ALDH1A1 3363/4885

“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.

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