SCHEMBL2374776

SCHEMBL2374776

COCCN(C)C(=O)[C@H](Cc1ccccc1)NCc1ccc(-c2cccnc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.45
MMP12 P39900 2/20 0.44
MME P08473 1/20 0.44
LMNA P02545 2/20 0.43
HTR5A P47898 1/20 0.43
HSD17B10 Q99714 2/20 0.41
MAPT P10636 1/20 0.41
SMPD1 P17405 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PSMB5 P28074 1/20 0.40
CTSV O60911 1/20 0.40
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
CTSS P25774 1/20 0.40
ECE1 P42892 1/20 0.40
ITGB1 P05556 1/20 0.40
ITGA4 P13612 1/20 0.40
HDAC8 Q9BY41 1/20 0.39
MKNK1 Q9BUB5 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
SCHEMBL2374783 1.00 PPARG (0.45) PPARGMMP12MMELMNAHTR5A
SCHEMBL2375179 0.91 MME (0.44) PPARGMMEHTR5ACTSLCTSB
SCHEMBL2375171 0.91 MME (0.44) PPARGMMEHTR5ACTSLCTSB
SCHEMBL2373930 0.91 GPR142 (0.46) PPARGMMEALDH1A1HDAC1CYP3A4
SCHEMBL2373927 0.91 GPR142 (0.46) PPARGMMEALDH1A1HDAC1CYP3A4
SCHEMBL2375746 0.85 PPARG (0.44) PPARGMMELMNAHSD17B10MAPT
SCHEMBL2375740 0.85 PPARG (0.44) PPARGMMELMNAHSD17B10MAPT
SCHEMBL2374270 0.76 L3MBTL1 (0.45) MAPTKDM4EALDH1A1CTSL
SCHEMBL2374260 0.76 L3MBTL1 (0.45) MAPTKDM4EALDH1A1CTSL
SCHEMBL16254308 0.75 MMP9 (0.45) MMELMNAHSD17B10ALDH1A1PSMB5

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 PPARG 1076/4885MMP12 2686/4885MME 1117/4885

“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.