SCHEMBL696444

SCHEMBL696444

Clc1ccc(COc2cc[c]cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.61
APP P05067 2/20 0.61
NR4A2 P43354 2/20 0.54
MAOA P21397 1/20 0.53
DHFR P00374 1/20 0.49
IDO1 P14902 2/20 0.47
AGXT P21549 2/20 0.47
BCHE P06276 1/20 0.46
LMNA P02545 2/20 0.45
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
CCR6 P51684 1/20 0.45
UBE2N P61088 1/20 0.45
KMT2A Q03164 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL10991891 0.85 MAOB (0.80) MAOBAPPNR4A2MAOADHFR
SCHEMBL7253638 0.82 IDO1 (0.45) MAOBAPPNR4A2MAOAIDO1
SCHEMBL6544765 0.82 APP (0.60) APPIDO1BCHELMNAKDM4E
SCHEMBL832412 0.81 GPR84 (0.50) MAOBAPPMAOANPC1RAB9A
SCHEMBL27553486 0.80 MAOB (0.61) MAOBAPPMAOARAB9A
SCHEMBL1283621 0.80 APP (0.61) MAOBAPPMAOAIDO1
SCHEMBL1282632 0.80 LMNA (0.62) MAOBAPPNR4A2MAOABCHE
SCHEMBL697362 0.80 MAOB (0.61) MAOBAPPNR4A2MAOAIDO1
SCHEMBL543113 0.80 MAOB (0.54) MAOBAPPMAOAAGXTLMNA
SCHEMBL696583 0.79 IDO1 (0.52) MAOBMAOAIDO1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108409837-B Glycopeptide compound with anti-drug resistance bacterial activity, preparation method and application thereof 上海来益生物药物研究开发中心有限责任公司 2021-09-24 CN claimed
WO-2019170046-A1 GLYCOPEPTIDE COMPOUNDS HAVING ACTIVITY OF RESISTING DRUG-RESISTANT BACTERIA, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海来益生物药物研究开发中心有限责任公司 2019-09-12 WO claimed
WO-2014186325-A1 PROCESSES AND INTERMEDIATES FOR PREPARING INDOLE PHARMACEUTICALS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2014-11-20 WO claimed
US-8362000-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2013-01-29 US claimed
EP-2421847-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP claimed
US-20110015171-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2011-01-20 US claimed
WO-2010124116-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO claimed
CN-100469788-C Glycopeptide phosphonate derivatives ADVANCED MEDICINE INC (US) 2009-03-18 CN claimed
CN-108409837-B Glycopeptide compound with anti-drug resistance bacterial activity, preparation method and application thereof 上海来益生物药物研究开发中心有限责任公司 2021-09-24 CN disclosed
WO-2019170046-A1 GLYCOPEPTIDE COMPOUNDS HAVING ACTIVITY OF RESISTING DRUG-RESISTANT BACTERIA, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海来益生物药物研究开发中心有限责任公司 2019-09-12 WO disclosed
US-9751835-B2 Processes and intermediates for preparing indole pharmaceuticals INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2017-09-05 US disclosed
US-9656991-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2017-05-23 US disclosed
EP-2865670-B1 Thiourea derivatives as glutaminyl cyclase inhibitors PROBIODRUG AG (DE) 2017-01-11 EP disclosed
US-9512082-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2016-12-06 US disclosed
EP-0165209-A2 o,p-Bifunctionalised, o'-substituted phenols CIBA-GEIGY AG (CH) 1985-12-18 EP disclosed
EP-0007347-B1 ALKYLENGLYCOL COMPOUNDS FOR LOWERING THE LIPID CONTENT AND PROCESSES FOR THE PREPARATION THEREOF SIEGFRIED AKTIENGESELLSCHAFT (CH) 1981-12-30 EP disclosed
US-4275068-A (BENZYLPHENOXY)-ALKANOLS AS ANTICHOLESTEROL AND ANTILIPEMIC AGENTS SIEGFRIED AG (CH) 1981-06-23 US disclosed
US-4198205-A SULFONIC ACID-FREE DISPERSE DYES BASF AKTIENGESELLSCHAFT (DE) 1980-04-15 US disclosed
EP-0007347-A1 Alkylenglycol compounds for lowering the lipid content and processes for the preparation thereof. SIEGFRIED AG (CH) 1980-02-06 EP disclosed
WO-1979000116-A1 NEW GLYCOL COMPOUNDS FOR LOWERING THE LIPID CONTENT SIEGFRIED AG (CH) 1979-03-08 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 (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-20110015171-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, LIPA MAOB 428/4885APP 3490/4885NR4A2 4177/4885

“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.