SCHEMBL3059707

SCHEMBL3059707

CC(C)CC(NC(=O)C(CO)NC(=O)C(N)Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.62
OPRD1 P41143 6/20 0.58
OPRM1 P35372 3/20 0.58
NPY1R P25929 1/20 0.56
NPY2R P49146 1/20 0.56
NPY4R P50391 1/20 0.56
LTA4H P09960 1/20 0.55
OPRK1 P41145 1/20 0.52
ACE P12821 1/20 0.52

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
SCHEMBL3059716 1.00 FOLH1 (0.62) FOLH1OPRD1OPRM1NPY1RNPY2R
Methane SCHEMBL29403415 0.99 FOLH1 (0.60) FOLH1OPRD1OPRM1NPY1RNPY2R
SCHEMBL29689931 0.99 FOLH1 (0.60) FOLH1OPRD1OPRM1NPY1RNPY2R
SCHEMBL30578468 0.98 FOLH1 (0.62) FOLH1OPRD1OPRM1NPY1RNPY2R
SCHEMBL31558391 0.94 OPRD1 (0.66) FOLH1OPRD1OPRM1NPY1RNPY2R
SCHEMBL30683246 0.94 FOLH1 (0.66) FOLH1OPRD1OPRM1NPY1RNPY2R
SCHEMBL29477112 0.94 FOLH1 (0.66) FOLH1OPRD1OPRM1NPY1RNPY2R
SCHEMBL29531738 0.94 FOLH1 (0.66) FOLH1OPRD1OPRM1NPY1RNPY2R
SCHEMBL29532240 0.94 FOLH1 (0.69) FOLH1OPRD1NPY1RNPY2RNPY4R
SCHEMBL14940816 0.94 FOLH1 (0.69) FOLH1OPRD1NPY1RNPY2RNPY4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110560015-A nano hydrated oxidized metal composite hydrogel and application of nano hydrated oxidized metal composite hydrogel in sewage treatment 魏旭榕 2019-12-13 CN claimed
CN-110560015-A nano hydrated oxidized metal composite hydrogel and application of nano hydrated oxidized metal composite hydrogel in sewage treatment 魏旭榕 2019-12-13 CN disclosed
CN-108840907-A Tyroserleutide-Phephorbide a monoesters and preparation method thereof 桂林市兴达光电医疗器械有限公司 2018-11-20 CN disclosed
CN-108771759-A Tyroserleutide-chlorin e 6 metal complex ester and preparation method thereof 桂林市兴达光电医疗器械有限公司 2018-11-09 CN disclosed
CN-108707183-A Tyroserleutide-chlorin e 6 monoesters and preparation method thereof 桂林市兴达光电医疗器械有限公司 2018-10-26 CN disclosed
CN-103910738-B A kind of Bisbenzylisoquinolincompounds quaternary ammonium salt and preparation method thereof and the application in preparing antitumor drug 山东师范大学 2016-07-06 CN disclosed
CN-103910740-B Tetrandrine derivant and preparation method thereof and the application in prepared by antitumor drug 山东师范大学 2016-07-06 CN disclosed
CN-103910741-B Bisbenzylisoquinolincompounds trimethyl-glycine and preparation method thereof and the application in antitumor drug preparation Shangdong Normal University (CN) 2016-04-13 CN disclosed
CN-104114537-A Substituted benzylamine compounds, their use in medicine, and in particular the treatment of hepatitis c virus (hcv) infection ASTEX THERAPEUTICS LTD 2014-10-22 CN disclosed
CN-104039766-A Pharmaceutical compounds ASTEX THERAPEUTICS LTD 2014-09-10 CN disclosed
CN-103923092-A Tetrandrine derivatives and preparation method and application thereof in preparation of antitumor medicine UNIV SHANDONG NORMAL 2014-07-16 CN disclosed
CN-103910741-A Bisbenzylisoquinoline betaine as well as preparation method thereof and application thereof in preparation of anti-tumor medicament UNIV SHANDONG NORMAL 2014-07-09 CN disclosed
CN-103910739-A Bisbenzylisoquinoline glycine betaines as well as preparation method and application thereof in preparing anti-tumor medicines UNIV SHANDONG NORMAL 2014-07-09 CN disclosed
CN-103910738-A Bisbenzylisoquinoline quaternary ammonium salt as well as preparation method and application thereof in preparing antitumor drug UNIV SHANDONG NORMAL 2014-07-09 CN disclosed
CN-103910740-A Tetrandrine derivatives and preparation method thereof, and application of tetrandrine derivatives in preparing anti-tumor medicines UNIV SHANDONG NORMAL 2014-07-09 CN disclosed
US-7696152-B2 Biologically active peptide consisting of tyrosyl-seryl-leucine (YSL) CMS Peptides Patent Holdings Company Limited (VG) 2010-04-13 US disclosed
US-7696152-B2 Biologically active peptide consisting of tyrosyl-seryl-leucine (YSL) CMS Peptides Patent Holdings Company Limited (VG) 2010-04-13 US disclosed
CN-100457922-C Method for detecting anti-liver cancer efficacy of tyroserleutide, kit and gene chip used thereby KANGZHE MEDICAL RES SHENZHEN C (CN) 2009-02-04 CN disclosed
CN-1837374-A Method for detecting anti-liver cancer efficacy of tyroserleutide, kit and gene chip used thereby YITAI MEDICAL RES SHENZHEN CO (CN) 2006-09-27 CN disclosed