SCHEMBL6706859

SCHEMBL6706859

O=C(O)NCCc1ccc(CN2CC=CC2)c(Br)c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 3/20 0.42
PLAAT3 P53816 1/20 0.37
PLAAT5 Q96KN8 1/20 0.37
PLAAT2 Q9NWW9 1/20 0.37
PLAAT4 Q9UL19 1/20 0.37
HRH3 Q9Y5N1 11/20 0.37
PTBP1 P26599 1/20 0.36
ESRRG P62508 1/20 0.35
CCR3 P51677 1/20 0.35

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
SCHEMBL6704645 0.81 KDM4E (0.47) MCHR1CCR3
SCHEMBL6705572 0.79 PLAAT3 (0.43) MCHR1PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL6705898 0.78 PLAAT3 (0.42) MCHR1PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL6224400 0.76 TAAR1 (0.39)
SCHEMBL6224858 0.76 CA2 (0.38) MCHR1
SCHEMBL27944339 0.73 PLK4 (0.55)
SCHEMBL5260776 0.72 PLAAT3 (0.48) PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL17646473 0.70 CNR1 (0.46) PLAAT3PLAAT5PLAAT2PLAAT4ESRRG
SCHEMBL17646483 0.69 PLAAT3 (0.48) PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL15319511 0.69 CA12 (0.56)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1678591-A Novel carboxamide compounds having MCH-antagonistic action, pharmaceutical preparations comprising said compounds and process for their preparation BOEHRINGER INGELHEIM INT (DE) 2005-10-05 CN 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

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 MCHR1 2/4885PLAAT3 4485/4885PLAAT5 3832/4885

“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.