SCHEMBL6223358

SCHEMBL6223358

CC1CCCN1Cc1ccc(CC(N)=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.60
▸ HRH3 Q9Y5N1 10/20 0.56
▸ KDM4E B2RXH2 2/20 0.54
▸ POLB P06746 1/20 0.51
▸ PARP1 P09874 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ LTA4H P09960 1/20 0.46
▸ BMPR1B O00238 1/20 0.45
▸ BMPR1A P36894 1/20 0.45
▸ TGFBR1 P36897 1/20 0.45
▸ ACVRL1 P37023 1/20 0.45
▸ ACVR1 Q04771 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ CRHBP P24387 1/20 0.45
▸ CRHR2 Q13324 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL6225119 0.96 ALDH1A1 (0.67) ALDH1A1HRH3KDM4EPOLBHPGD
SCHEMBL6224387 0.82 ALDH1A1 (0.48) ALDH1A1HRH3HPGDSMN1; SMN2
SCHEMBL24522256 0.81 HRH3 (0.71) ALDH1A1HRH3KDM4EPARP1LTA4H
SCHEMBL3562026 0.80 ALDH1A1 (0.90) ALDH1A1HRH3KDM4EPOLBPARP1
SCHEMBL20207141 0.79 OPRK1 (0.56) ALDH1A1HRH3
SCHEMBL16480464 0.78 ALDH1A1 (0.66) ALDH1A1HRH3KDM4EPARP1HPGD
SCHEMBL6705857 0.77 ALDH1A1 (0.69) ALDH1A1HRH3KDM4EPARP1LTA4H
SCHEMBL21163109 0.76 ALDH1A1 (0.73) ALDH1A1HRH3KDM4EPOLBLTA4H
SCHEMBL4770791 0.76 ALDH1A1 (0.64) ALDH1A1HRH3KDM4EPOLBPARP1
SCHEMBL4610176 0.76 ALDH1A1 (0.64) ALDH1A1HRH3KDM4EPOLBPARP1

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 ALDH1A1 3363/4885HRH3 254/4885KDM4E 492/4885

“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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