SCHEMBL2373794

SCHEMBL2373794

CN(C)C1CCN(C(=O)[C@H](Cc2ccccc2)NCc2ccc(N3CCOCC3)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
MMP8 P22894 1/20 0.43
MCHR1 Q99705 2/20 0.42
RORC P51449 1/20 0.42
TACR1 P25103 4/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 2/20 0.41
GFER P55789 1/20 0.40
OPRD1 P41143 1/20 0.40
MAPT P10636 1/20 0.40
REN P00797 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL2373800 1.00 L3MBTL1 (0.45) L3MBTL1MMP8MCHR1RORCTACR1
SCHEMBL2373787 0.90 GAA (0.52) L3MBTL1RORCSMN1; SMN2POLBGFER
SCHEMBL2373778 0.90 GAA (0.52) L3MBTL1RORCSMN1; SMN2POLBGFER
SCHEMBL2373502 0.82 GPR142 (0.44) MCHR1TACR1OPRD1
SCHEMBL2373494 0.82 GPR142 (0.44) MCHR1TACR1OPRD1
SCHEMBL2375944 0.80 MCHR1 (0.45) MCHR1TACR1OPRD1MEN1KMT2A
SCHEMBL2375951 0.80 MCHR1 (0.45) MCHR1TACR1OPRD1MEN1KMT2A
SCHEMBL2374734 0.80 DPP4 (0.46) MCHR1TACR1SMN1; SMN2OPRD1
SCHEMBL2374722 0.80 DPP4 (0.46) MCHR1TACR1SMN1; SMN2OPRD1
SCHEMBL2375734 0.79 POLB (0.57) L3MBTL1SMN1; SMN2POLBGFERMAPT

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 L3MBTL1 3413/4885MMP8 2785/4885MCHR1 4167/4885

“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.