SCHEMBL2339741

SCHEMBL2339741

NCCC(=O)NC(Cc1ccc(O)c(O)c1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 3/20 0.58
▸ CA2 P00918 3/20 0.58
▸ LCK P06239 2/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ USP2 O75604 1/20 0.55
▸ EGFR P00533 1/20 0.55
▸ FYN P06241 1/20 0.55
▸ ADORA3 P0DMS8 1/20 0.55
▸ ALOX15 P16050 1/20 0.55
▸ PTGS1 P23219 1/20 0.55
▸ HTR2A P28223 1/20 0.55
▸ PTGS2 P35354 1/20 0.55
▸ RECQL P46063 1/20 0.55
▸ SLC7A5 Q01650 1/20 0.55
▸ HIF1A Q16665 1/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ FOLH1 Q04609 3/20 0.53
▸ ACE P12821 3/20 0.53
▸ MME P08473 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
SCHEMBL2339748 1.00 CA1 (0.58) CA1CA2LCKKDM4EUSP2
SCHEMBL10099813 0.92 CA1 (0.56) CA1CA2LCKKDM4EUSP2
SCHEMBL11850661 0.88 CA2 (0.61) CA1CA2LCKKDM4EUSP2
SCHEMBL11277926 0.86 CA2 (0.55) CA1CA2LCKKDM4EUSP2
SCHEMBL18619736 0.86 MME (0.56) CA1CA2LCKKDM4EUSP2
SCHEMBL10824355 0.85 NAALAD2 (0.59) CA1CA2FOLH1ACEMME
SCHEMBL4629789 0.85 NAALAD2 (0.59) CA1CA2FOLH1ACEMME
SCHEMBL7293429 0.85 SLC7A5 (0.62) CA1CA2LCKKDM4EUSP2
SCHEMBL27753212 0.85 SLC7A5 (0.62) CA1CA2LCKKDM4EUSP2
SCHEMBL11576781 0.85 SLC7A5 (0.62) CA1CA2LCKKDM4EUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170112773-A1 PLASMA MEMBRANE VESICLES COMPRISING FUNCTIONAL TRANSMEMBRANE PROTEINS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2017-04-27 — — US disclosed
EP-1829526-B1 LIPOSOME AND METHOD OF INJECTING SUBSTANCE INTO CELL BY USING THE SAME NAT UNIV CORP TOKYO MED & DENT (JP) 2016-01-20 — — EP disclosed
US-9023384-B2 Liposome and method for injecting substance to cell using this liposome TOKYO MEDICAL AND DENTAL UNIVERSITY (JP) 2015-05-05 — — US disclosed
US-8304452-B2 Radical scavenger and active oxygen eliminating agent INBIOTEX INC. (JP) 2012-11-06 — — US disclosed
US-20110212883-A1 RADICAL SCAVENGER AND ACTIVE OXYGEN ELIMINATING AGENT INBIOTEX INC. (JP) 2011-09-01 — — US disclosed
EP-1897549-B1 RADICAL SCAVENGER AND ACTIVE OXYGEN ELIMINATING AGENT INBIOTEX INC (JP) 2011-08-24 — — EP disclosed
US-20100137635-A1 RADICAL SCAVENGER AND ACTIVE OXYGEN ELIMINATING AGENT INBIOTEX INC. (JP) 2010-06-03 — — US disclosed
US-20080279918-A1 Composition charged with liposome; injecting into target cell; in vitro protein synthesis in gap between liposomes; drug delivery NATIONAL UNIVERSITY CORPORATION TOKYO MEDICAL AND DENTAL UNIVERSITY (JP) 2008-11-13 — — US disclosed
EP-1897549-A1 RADICAL SCAVENGER AND ACTIVE OXYGEN ELIMINATING AGENT InBiotex inc. (JP) 2008-03-12 — — EP disclosed
EP-1829526-A1 LIPOSOME AND METHOD OF INJECTING SUBSTANCE INTO CELL BY USING THE SAME National Universiy Corporation Tokyo Medical and Dental University (JP) 2007-09-05 — — EP disclosed
WO-2007013147-A1 ANGIOGENESIS INHIBITOR AND VASCULAR REGRESSIVE AGENT INBIOTEX INC. (JP) 2007-02-01 — — WO disclosed
JP-2005213159-A NEOVASCULARIZATION INHIBITOR AND VASCULAR RETRACTION AGENT INBIOTEX:KK 2005-08-11 — — JP disclosed
JP-2001213799-A ANTINEOPLASTIC INST OF PHYSICAL & CHEMICAL RES 2001-08-07 — — JP 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-20100137635-A1 RADICAL SCAVENGER AND ACTIVE OXYGEN ELIMINATING AGENT GLO1, GPX1, GPX4 CA1 2218/4885CA2 1233/4885LCK 4110/4885
US-20110212883-A1 RADICAL SCAVENGER AND ACTIVE OXYGEN ELIMINATING AGENT GLO1, GPX1, GPX4 CA1 2473/4885CA2 1280/4885LCK 3859/4885

“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.

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