SCHEMBL8799322

SCHEMBL8799322

CCCCCCCCCCCCC(=O)S

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.62
CES1 P23141 4/20 0.62
GPR84 Q9NQS5 7/20 0.59
PPARG P37231 7/20 0.59
PPARD Q03181 7/20 0.59
PPARA Q07869 7/20 0.59
HDAC11 Q96DB2 5/20 0.59
TSHR P16473 5/20 0.59
PTPN1 P18031 3/20 0.59
ALDH1A1 P00352 3/20 0.59
TLR2 O60603 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
FABP4 P15090 2/20 0.59
KMT2A Q03164 2/20 0.59
SLC22A6 Q4U2R8 1/20 0.59
SLC22A8 Q8TCC7 1/20 0.59
MEN1 O00255 1/20 0.59
ESR1 P03372 1/20 0.59
ALOX15 P16050 1/20 0.59
PDE4A P27815 1/20 0.59

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
SCHEMBL2770033 1.00 CES2 (0.62) CES2CES1GPR84PPARGPPARD
SCHEMBL8364614 1.00 CES2 (0.62) CES2CES1GPR84PPARGPPARD
SCHEMBL368595 1.00
SCHEMBL8368438 1.00 CES2 (0.62) CES2CES1GPR84PPARGPPARD
SCHEMBL5179381 1.00 CES2 (0.62) CES2CES1GPR84PPARGPPARD
SCHEMBL8367953 1.00 CES2 (0.62) CES2CES1GPR84PPARGPPARD
SCHEMBL8367955 1.00 CES2 (0.62) CES2CES1GPR84PPARGPPARD
SCHEMBL583038 1.00 CES2 (0.62) CES2CES1GPR84PPARGPPARD
SCHEMBL543736 1.00 CES2 (0.62) CES2CES1GPR84PPARGPPARD
SCHEMBL8364543 1.00 CES2 (0.62) CES2CES1GPR84PPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170335037-A1 VULCANIZABLE COMPOSITIONS CONTAINING EPOXY GROUP-CONTAINING ETHYLENE-VINYL ACETATE COPOLYMERS ARLANXEO DEUTSCHLAND GMBH (DE) 2017-11-23 US disclosed
US-8933195-B2 Histone deacetylase inhibitors and synthetic method thereof and use thereof in manufacture of medicaments NANJING YOKO BIOMEDICAL R & D LTD. (CN) 2015-01-13 US disclosed
US-8933195-B2 Histone deacetylase inhibitors and synthetic method thereof and use thereof in manufacture of medicaments NANJING YOKO BIOMEDICAL R & D LTD. (CN) 2015-01-13 US disclosed
US-20140243501-A1 HISTONE DEACETYLASE INHIBITORS AND SYNTHETIC METHOD THEREOF AND USE THEREOF IN MANUFACTURE OF MEDICAMENTS NANJING YOKO BIOMEDICAL R & D LTD. [CN/CN] (CN) 2014-08-28 US disclosed
US-20140243501-A1 HISTONE DEACETYLASE INHIBITORS AND SYNTHETIC METHOD THEREOF AND USE THEREOF IN MANUFACTURE OF MEDICAMENTS NANJING YOKO BIOMEDICAL R & D LTD. [CN/CN] (CN) 2014-08-28 US disclosed
WO-2013071715-A1 HISTONE DEACETYLASE INHIBITORS AND SYNTHETIC METHOD THEREOF AND USE THEREOF IN MANUFACTURE OF MEDICAMENTS 南京优科生物医药研究有限公司 (CN) 2013-05-23 WO disclosed
US-5650430-A Radicicol derivatives, their preparation and their anti-tumor activity SANKYO COMPANY, LIMITED (JP) 1997-07-22 US disclosed
EP-0460950-B1 Radicicol derivatives, their preparation and their anti-tumour activity SANKYO CO (JP) 1997-03-05 EP disclosed
US-5597846-A ESTERS OF RADICICOL SANKYO COMPANY, LIMITED (JP) 1997-01-28 US disclosed
EP-0316934-B1 MURAMYL PEPTIDE DERIVATIVES AND USE THEREOF Hasegawa, Akira (JP) 1993-08-18 EP disclosed
WO-1991018905-A1 RADICICOL DERIVATIVES, THEIR PREPARATION AND THEIR ANTI-TUMOR ACTIVITY SANKYO COMPANY LIMITED (JP) 1991-12-12 WO disclosed
EP-0460950-A1 Radicicol derivatives, their preparation and their anti-tumour activity Sankyo Company Limited (JP) 1991-12-11 EP disclosed
US-4895835-A IMMUNOMODULATORS NISSHIN OIL MILLS, LTD. (JP) 1990-01-23 US disclosed
EP-0319316-A2 Griseolic acid monoesters, their preparation and use SANKYO COMPANY LIMITED (JP) 1989-06-07 EP disclosed
EP-0316934-A2 Muramyl peptide derivatives and use thereof Hasegawa, Akira (JP) 1989-05-24 EP 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-20140243501-A1 HISTONE DEACETYLASE INHIBITORS AND SYNTHETIC METHOD THEREOF AND USE THEREOF IN MANUFACTURE OF MEDICAMENTS HDAC1, HDAC11, HDAC2 CES2 1320/4885CES1 499/4885GPR84 1314/4885

“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.