SCHEMBL2375951

SCHEMBL2375951

CN(C)C1CCN(C(=O)C(Cc2ccccc2)NCc2ccc(-c3cncnc3)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 3/20 0.45
F2 P00734 2/20 0.40
DPP4 P27487 1/20 0.40
DPP8 Q6V1X1 1/20 0.40
DPP7 Q9UHL4 1/20 0.40
TACR1 P25103 4/20 0.40
OPRD1 P41143 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
HDAC1 Q13547 1/20 0.39
GPR119 Q8TDV5 1/20 0.38
RAB9A P51151 1/20 0.38
HTR1A P08908 1/20 0.38
HTR1B P28222 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38

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
SCHEMBL2375944 1.00 MCHR1 (0.45) MCHR1F2DPP4DPP8DPP7
SCHEMBL2373494 0.91 GPR142 (0.44) MCHR1F2TACR1OPRD1
SCHEMBL2373502 0.91 GPR142 (0.44) MCHR1F2TACR1OPRD1
SCHEMBL2374598 0.87 CCR1 (0.45) TACR1
SCHEMBL2374601 0.87 CCR1 (0.45) TACR1
SCHEMBL2374722 0.84 DPP4 (0.46) MCHR1DPP4DPP7TACR1OPRD1
SCHEMBL2374734 0.84 DPP4 (0.46) MCHR1DPP4DPP7TACR1OPRD1
SCHEMBL2373800 0.80 L3MBTL1 (0.45) MCHR1TACR1OPRD1KMT2AMEN1
SCHEMBL2373794 0.80 L3MBTL1 (0.45) MCHR1TACR1OPRD1KMT2AMEN1
SCHEMBL2373778 0.80 GAA (0.52) KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110224210-A1 NOVEL BIS-AMIDES AS ANTI-MALARIAL AGENTS ACTELION PHARMACEUTICALS LTD. (CH) 2011-09-15 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-20110224210-A1 NOVEL BIS-AMIDES AS ANTI-MALARIAL AGENTS CTSA, BECN1, HDAC6 MCHR1 4167/4885F2 2977/4885DPP4 754/4885

“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.