SCHEMBL2312372

SCHEMBL2312372

NC(Cc1ccccc1)C(=O)Nc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.63
HDAC8 Q9BY41 1/20 0.63
ALPI P09923 1/20 0.61
PKM P14618 1/20 0.61
PTGS1 P23219 1/20 0.61
XIAP P98170 1/20 0.61
SLC7A5 Q01650 1/20 0.61
SLC15A1 P46059 1/20 0.57
CTSC P53634 1/20 0.56
AKT1 P31749 1/20 0.55
CIT O14578 1/20 0.55
LTA4H P09960 5/20 0.54
MEN1 O00255 1/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
KMT2A Q03164 1/20 0.53

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
SCHEMBL28279157 1.00 BACE1 (0.63) BACE1HDAC8ALPIPKMPTGS1
SCHEMBL2312361 1.00 BACE1 (0.63) BACE1HDAC8ALPIPKMPTGS1
Hydrochloric Acid SCHEMBL5960990 0.98 HDAC8 (0.65) BACE1HDAC8ALPIPKMPTGS1
Hydrochloric Acid SCHEMBL5960992 0.98 HDAC8 (0.65) BACE1HDAC8ALPIPKMPTGS1
SCHEMBL11880637 0.90 BACE1 (0.68) BACE1HDAC8SLC7A5CIT
SCHEMBL16993871 0.90 BACE1 (0.68) BACE1HDAC8SLC7A5CIT
SCHEMBL23477267 0.89 BACE1 (0.60) BACE1HDAC8ALPIPKMPTGS1
SCHEMBL4522561 0.89 MEN1 (0.69) BACE1HDAC8ALPIPKMPTGS1
SCHEMBL7289459 0.89 BACE1 (0.60) BACE1HDAC8ALPIPKMPTGS1
SCHEMBL9590958 0.89 AKT1 (0.66) BACE1HDAC8ALPIPKMPTGS1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3342599-B1 HEAT-SENSITIVE RECORDING MATERIAL SANKO CO LTD (JP) 2021-06-16 EP disclosed
WO-2021110076-A1 OXAMIDE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE 深圳信立泰药业股份有限公司 2021-06-10 WO disclosed
CN-109438277-A Oximido naphthoquinone compound and its preparation method and application 普济生物科技(台州)有限公司 2019-03-08 CN disclosed
US-10086634-B2 Heat-sensitive recording material SANKO CO., LTD. (JP) 2018-10-02 US disclosed
US-20180194151-A1 HEAT-SENSITIVE RECORDING MATERIAL SANKO CO., LTD. (JP) 2018-07-12 US disclosed
EP-3342599-A1 HEAT-SENSITIVE RECORDING MATERIAL Sanko Co., Ltd. (JP) 2018-07-04 EP disclosed
CN-105732413-B The synthesis technique of chiral N aryl amino acids acid amides 成都理工大学 2017-08-25 CN disclosed
US-8288549-B2 Glycine B antagonist MERZ PHARMA GMBH & CO. KGAA (DE) 2012-10-16 US disclosed
US-20120136176-A1 CATALYST FOR ASYMMETRIC HYDROGENATION AND METHOD FOR MANUFACTURING OPTICALLY ACTIVE CARBONYL COMPOUND USING THE SAME TAKASAGO INTERNATIONAL CORPORATION (JP) 2012-05-31 US disclosed
US-20110190342-A1 GLYCINE B ANTAGONIST HENRICH MARKUS 2011-08-04 US disclosed
CN-1264817-C Certain cyclic thio substitued acylaminoacid amide derivatives NOVARTIS AG (CH) 2006-07-19 CN disclosed
CN-1313776-A Therapeutic agent for allergic diseases FUJI PHARMACEUTICAL INDUSTRY C (JP) 2001-09-19 CN disclosed
US-6114381-A TO CONTROL BRAIN DAMAGE ASSOCIATED WITH ANOXIA OR ISCHEMIA WHICH TYPICALLY FOLLOWS STROKE, CARDIAC ARREST OR PERINATAL ASPHYXIA; COMPOUND IS AN ANTAGONIST TO INHIBIT EXCITOTOXIC ACTIONS AT EXCITATORY AMINO ACID RECEPTOR SITES G. D. SEARLE & CO. (US) 2000-09-05 US disclosed
CN-1251092-A Certain cyclic thio substitued acylaminoacid amide derivatives NOVARTIS AG (CH) 2000-04-19 CN disclosed
CN-1049651-C Metalloproteinase inhibitors BRITISH BIOTECH PHARM (GB) 2000-02-23 CN disclosed
EP-0966439-A1 CERTAIN CYCLIC THIO SUBSTITUTED ACYLAMINOACID AMIDE DERIVATIVES Novartis AG (CH) 1999-12-29 EP disclosed
WO-1998042662-A1 CERTAIN CYCLIC THIO SUBSTITUTED ACYLAMINOACID AMIDE DERIVATIVES NOVARTIS AG (CH) 1998-10-01 WO disclosed
CN-1138851-A Metalloproteinase inhibitors BRITISH BIOTECH PHARM (GB) 1996-12-25 CN disclosed
EP-0740652-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1996-11-06 EP disclosed
WO-1995019956-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1995-07-27 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 (4 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-20180194151-A1 HEAT-SENSITIVE RECORDING MATERIAL ASIC1, SCN1A, NPR1 BACE1 1609/4885HDAC8 3705/4885ALPI 3464/4885
US-20120136176-A1 CATALYST FOR ASYMMETRIC HYDROGENATION AND METHOD FOR MANUFACTURING OPTICALLY ACTIVE CARBONYL COMPOUND USING THE SAME HMOX1, HIRA, HRH1 BACE1 15/4885HDAC8 2466/4885ALPI 3442/4885
US-10086634-B2 Heat-sensitive recording material ASIC1, SCN1A, NPR1 BACE1 1411/4885HDAC8 3799/4885ALPI 3593/4885
US-20110190342-A1 GLYCINE B ANTAGONIST GRIN2B, GLRB, GRIN2A BACE1 651/4885HDAC8 4794/4885ALPI 4486/4885

“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.