SCHEMBL2473683

SCHEMBL2473683

O=C(O)Cc1cccc(C(=O)c2cccs2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.60
HPGD P15428 5/20 0.52
ALDH1A1 P00352 3/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
USP2 O75604 1/20 0.52
HSD17B10 Q99714 1/20 0.52
TP53 P04637 2/20 0.50
CNR2 P34972 1/20 0.50
HTT P42858 1/20 0.47
PTGS1 P23219 2/20 0.47
PTGS2 P35354 2/20 0.47
ALOX5 P09917 1/20 0.47
MAPT P10636 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CYP2C9 P11712 2/20 0.44
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL11204448 0.85 HPGDS (0.57) HPGDSHPGDALDH1A1MEN1KMT2A
SCHEMBL11291627 0.83 HPGDS (0.66) HPGDSHPGDALDH1A1MEN1KMT2A
SCHEMBL19202273 0.82 AKR1B1 (0.58) HPGDHSD17B10MAPTLMNAKDM4E
SCHEMBL18906076 0.79 HPGDS (0.70) HPGDSHPGDALDH1A1MEN1KMT2A
SCHEMBL512838 0.79 ATM (0.63) ALDH1A1
SCHEMBL11459750 0.78 HDAC3 (0.47) HPGDKMT2AKDM4E
Hydrochloric Acid SCHEMBL11844165 0.77 ATM (0.61) ALDH1A1
Methane SCHEMBL11262863 0.77 ATM (0.61) ALDH1A1
SCHEMBL19202271 0.77 AKR1B1 (0.52) HPGDHSD17B10MAPTLMNAKDM4E
SCHEMBL27533213 0.77 HPGDS (0.53) HPGDSHPGDALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111808011-B High penetration composition and its application 泰飞尔生物医药(苏州)有限公司 2024-02-27 CN disclosed
US-20230233516-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS TECHFIELDS PHARMA CO., LTD (CN) 2023-07-27 US disclosed
US-11541029-B2 High penetration compositions and their applications TECHFIELDS PHARMA CO., LTD. (CN) 2023-01-03 US disclosed
CN-107320732-B High penetration composition and application thereof 于崇曦 2021-09-07 CN disclosed
CN-108191846-B High penetration composition and application thereof 于崇曦 2021-08-20 CN disclosed
CN-111808011-A High penetration composition and application thereof 于崇曦 2020-10-23 CN disclosed
CN-108191846-A High-penetration composition and its application 于崇曦 2018-06-22 CN disclosed
CN-107320732-A High-penetration composition and its application 于崇曦 2017-11-07 CN disclosed
CN-107261149-A High-penetration composition and its application 于崇曦 2017-10-20 CN disclosed
US-9700633-B2 Conjugates of water soluble polymer-amino acid oligopeptide-drug, preparation method and use thereof JENKEM TECHNOLOGY CO., LTD., TIANJIN BRANCH (CN) 2017-07-11 US disclosed
US-20150359900-A1 CONJUGATES OF WATER SOLUBLE POLYMER-AMINO ACID OLIGOPEPTIDE-DRUG, PREPARATION METHOD AND USE THEREOF JENKEM TECHNOLOGY CO. LTD., TIANJIN BRANCH (CN) 2015-12-17 US disclosed
US-20110269689-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS PREMIER RESEARCH INTERNATIONAL, LLC 2011-11-03 US disclosed
EP-2370406-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS Yu, Chongxi (US) 2011-10-05 EP disclosed
WO-2010065936-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS YU CHONGXI (US) 2010-06-10 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-20150359900-A1 CONJUGATES OF WATER SOLUBLE POLYMER-AMINO ACID OLIGOPEPTIDE-DRUG, PREPARATION METHOD AND USE THEREOF SLC7A1, NPPA, PEPD HPGDS 1437/4885HPGD 2713/4885ALDH1A1 2543/4885
US-20110269689-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS SLC19A1, HIRA, SLC43A1 HPGDS 59/4885HPGD 194/4885ALDH1A1 829/4885
US-11541029-B2 High penetration compositions and their applications SLC19A1, HIRA, SLC43A1 HPGDS 59/4885HPGD 194/4885ALDH1A1 829/4885
US-20230233516-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS SLC5A7, SLC19A1, SLC43A1 HPGDS 85/4885HPGD 182/4885ALDH1A1 2302/4885

“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.