SCHEMBL900512

SCHEMBL900512

OCc1ccccc1-c1nc2ccccc2s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.58
RAB9A P51151 9/20 0.58
NPC1 O15118 8/20 0.58
ALDH1A1 P00352 7/20 0.58
MAPT P10636 6/20 0.58
SMN1; SMN2 Q16637 6/20 0.58
GAA P10253 5/20 0.58
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
TDP1 Q9NUW8 3/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
NPSR1 Q6W5P4 1/20 0.54
POLB P06746 3/20 0.50
GLA P06280 3/20 0.50
HSD17B10 Q99714 3/20 0.50
LMNA P02545 2/20 0.50
APP P05067 1/20 0.50
THRB P10828 1/20 0.50
ALOX15 P16050 1/20 0.50
CASP1 P29466 1/20 0.50

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
SCHEMBL21301181 0.83 KDM4E (0.58) KDM4ERAB9ANPC1ALDH1A1MAPT
SCHEMBL4907798 0.83 KDM4E (0.58) KDM4ERAB9ANPC1ALDH1A1MAPT
SCHEMBL21699657 0.83 KDM4E (0.58) KDM4ERAB9ANPC1ALDH1A1MAPT
SCHEMBL11489855 0.83 KDM4E (0.58) KDM4ERAB9ANPC1ALDH1A1MAPT
SCHEMBL21779833 0.83 KDM4E (0.63) KDM4ERAB9ANPC1ALDH1A1MAPT
SCHEMBL24182079 0.83 KDM4E (0.63) KDM4ERAB9ANPC1ALDH1A1MAPT
SCHEMBL231307 0.82 KDM4E (0.75) KDM4ERAB9ANPC1ALDH1A1MAPT
SCHEMBL21362250 0.81 KDM4E (0.59) KDM4ERAB9ANPC1ALDH1A1MAPT
SCHEMBL8045063 0.81 KDM4E (0.55) KDM4ERAB9ANPC1ALDH1A1MAPT
SCHEMBL12854008 0.80 KDM4E (0.72) KDM4ERAB9ANPC1ALDH1A1MAPT

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 11 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
CN-103228643-B As the benzoxazole derivative of histamine h 4 receptor part BIOPROJET (FR) 2015-11-25 CN 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
CN-103228643-A Benzazole derivatives as histamine H4 receptor ligands BIOPROJET SOC CIV 2013-07-31 CN 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
US-20080299041-A1 HETEROCYCLIC INDENE DERIVATIVES AND THEIR RADIOISOTOPE LABELED COMPOUNDS FOR IMAGING BETA-AMYLOID DEPOSITION SEOUL NATIONAL UNIVERSITY INDUSTRY FOUNDATION (KR) 2008-12-04 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 (3 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 KDM4E 1546/4885RAB9A 2931/4885NPC1 2379/4885
US-20130231329-A1 Benzazole Derivatives as Histamine H4 Receptor Ligands HRH4, HRH3, HRH2 KDM4E 2139/4885RAB9A 2802/4885NPC1 2013/4885
US-20080299041-A1 HETEROCYCLIC INDENE DERIVATIVES AND THEIR RADIOISOTOPE LABELED COMPOUNDS FOR IMAGING BETA-AMYLOID DEPOSITION APP, BACE1, PSEN1 KDM4E 3533/4885RAB9A 2635/4885NPC1 41/4885

“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.