SCHEMBL900311

SCHEMBL900311

CCCOc1cccc(C(=O)c2nc3ccccc3s2)c1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
FAAH O00519 1/20 0.56
KMT2A Q03164 3/20 0.53
HSD17B1 P14061 2/20 0.51
HSD17B2 P37059 2/20 0.51
SCD O00767 1/20 0.51
NPC1 O15118 2/20 0.48
BCL2 P10415 1/20 0.47
MCL1 Q07820 1/20 0.47
BAD Q92934 1/20 0.47
MEN1 O00255 2/20 0.47
RAB9A P51151 1/20 0.47
DHODH Q02127 1/20 0.47
ALDH1A1 P00352 1/20 0.47
PDE10A Q9Y233 1/20 0.47
KAT6A Q92794 1/20 0.47

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
SCHEMBL31078 0.84 RAB9A (0.65) MAPTFAAHKMT2AHSD17B1HSD17B2
SCHEMBL7937656 0.82 PDE10A (0.57) MAPTHSD17B1HSD17B2SCDNPC1
SCHEMBL27913517 0.78 KMT2A (0.78) MAPTKMT2ANPC1MEN1RAB9A
SCHEMBL900711 0.77 SCD (0.62) MAPTFAAHKMT2AHSD17B1HSD17B2
SCHEMBL13173989 0.77 MAPT (0.76) MAPTKMT2ANPC1MEN1RAB9A
SCHEMBL11696519 0.77 KMT2A (0.77) MAPTKMT2ANPC1RAB9AALDH1A1
SCHEMBL12980301 0.76 MAPT (0.76) MAPTRAB9A
SCHEMBL31407 0.76 HSD17B1 (0.79) FAAHHSD17B1HSD17B2BCL2MCL1
SCHEMBL900213 0.75 MAPT (0.45) MAPTFAAHKMT2ANPC1RAB9A
SCHEMBL900212 0.75 MAPT (0.45) MAPTFAAHKMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2621916-B1 BENZAZOLE DERIVATIVES AS HISTAMINE H4 RECEPTOR LIGANDS BIOPROJET SOC CIV (FR) 2016-02-10 EP disclosed
US-9029357-B2 Benzazole derivatives as histamine H4 receptor ligands BIOPROJET (FR) 2015-05-12 US disclosed
US-20150004181-A1 Benzazole Derivatives as Histamine H4 Receptor Ligands BIOPROJET SOC CIV (FR) 2015-01-01 US disclosed
US-8802664-B2 Benzazole derivatives as histamine H4 receptor ligands BIOPROJECT (FR) 2014-08-12 US disclosed
US-20130231329-A1 Benzazole Derivatives as Histamine H4 Receptor Ligands BIOPROJET (FR) 2013-09-05 US disclosed
EP-2621916-A1 BENZAZOLE DERIVATIVES AS HISTAMINE H4 RECEPTOR LIGANDS BIOPROJET (FR) 2013-08-07 EP disclosed
EP-2447263-A1 Benzazole derivatives as histamine H4 receptor ligands BIOPROJET (FR) 2012-05-02 EP disclosed
WO-2012041860-A1 BENZAZOLE DERIVATIVES AS HISTAMINE H4 RECEPTOR LIGANDS BIOPROJET (FR) 2012-04-05 WO 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 (2 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-20150004181-A1 Benzazole Derivatives as Histamine H4 Receptor Ligands HRH4, HRH3, HRH2 MAPT 2901/4885FAAH 612/4885KMT2A 1048/4885
US-20130231329-A1 Benzazole Derivatives as Histamine H4 Receptor Ligands HRH4, HRH3, HRH2 MAPT 3180/4885FAAH 542/4885KMT2A 1334/4885

“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.