SCHEMBL2364095

SCHEMBL2364095

COCCN(C)C(=O)C(Cc1ccccc1)N(Cc1ccc(-c2ccncc2)cc1)C(=O)C=Cc1ccc(OC)nc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 1/20 0.42
TRPM8 Q7Z2W7 3/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NOX1 Q9Y5S8 2/20 0.37
GHSR Q92847 1/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
AKT1 P31749 1/20 0.37
MAPK1 P28482 1/20 0.37
MME P08473 1/20 0.36
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.35
SNCA P37840 1/20 0.35
TAS2R14 Q9NYV8 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
SCHEMBL2364092 1.00 HTR5A (0.42) HTR5ATRPM8ALDH1A1KDM4ENOX1
SCHEMBL2364093 1.00 HTR5A (0.42) HTR5ATRPM8ALDH1A1KDM4ENOX1
SCHEMBL2336717 0.95 HTR5A (0.44) HTR5ATRPM8ALDH1A1KDM4EKMT2A
SCHEMBL2336714 0.95 HTR5A (0.44) HTR5ATRPM8ALDH1A1KDM4EKMT2A
SCHEMBL2336709 0.95 HTR5A (0.44) HTR5ATRPM8ALDH1A1KDM4EKMT2A
SCHEMBL2376033 0.93 TRPM8 (0.40) HTR5ATRPM8ALDH1A1KDM4EGHSR
SCHEMBL2376030 0.93 TRPM8 (0.40) HTR5ATRPM8ALDH1A1KDM4EGHSR
SCHEMBL2376027 0.93 TRPM8 (0.40) HTR5ATRPM8ALDH1A1KDM4EGHSR
SCHEMBL2376010 0.91 HTR5A (0.42) HTR5ATRPM8ALDH1A1KDM4EGHSR
SCHEMBL2376007 0.91 HTR5A (0.42) HTR5ATRPM8ALDH1A1KDM4EGHSR

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 4 patents. 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 claimed
EP-2358673-A1 NOVEL BIS-AMIDES AS ANTIMALARIAL AGENTS Actelion Pharmaceuticals Ltd. (CH) 2011-08-24 EP claimed
WO-2010058353-A1 NOVEL BIS-AMIDES AS ANTIMALARIAL AGENTS ACTELION PHARMACEUTICALS LTD (CH) 2010-05-27 WO claimed
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 HTR5A 4420/4885TRPM8 2184/4885ALDH1A1 3251/4885

“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.