SCHEMBL44801

SCHEMBL44801

O=C(O)CCSCc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 1.00
PTGER1 P34995 1/20 0.58
PTGER4 P35408 1/20 0.58
PTGER3 P43115 1/20 0.58
PTGER2 P43116 1/20 0.58
HPGD P15428 4/20 0.54
ALDH1A1 P00352 4/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
LMNA P02545 2/20 0.54
KEAP1 Q14145 1/20 0.54
KMT2A Q03164 1/20 0.52
HSD17B10 Q99714 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
USP2 O75604 1/20 0.51
HDAC3 O15379 1/20 0.50
MAPK1 P28482 1/20 0.50
ADRA1A P35348 1/20 0.50
HDAC4 P56524 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HDAC1 Q13547 1/20 0.50

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
SCHEMBL5180190 0.88 CYP2C19 (0.79) CYP2C19PTGER1PTGER4PTGER3PTGER2
SCHEMBL713206 0.86 CYP2C19 (0.76) CYP2C19PTGER1PTGER4PTGER3PTGER2
SCHEMBL1585162 0.85 CYP2C19 (0.73) CYP2C19PTGER1PTGER4PTGER3PTGER2
SCHEMBL3938443 0.85 CYP2C19 (0.73) CYP2C19PTGER1PTGER4PTGER3PTGER2
SCHEMBL28501432 0.85 CYP2C19 (0.73) CYP2C19PTGER1PTGER4PTGER3PTGER2
Succinic Acid SCHEMBL11863609 0.85 CYP2C19 (0.73) CYP2C19PTGER1PTGER4PTGER3PTGER2
SCHEMBL4133539 0.84 CYP2C19 (0.72) CYP2C19PTGER1PTGER4PTGER3PTGER2
SCHEMBL5935700 0.84 CYP2C19 (0.72) CYP2C19PTGER1PTGER4PTGER3PTGER2
SCHEMBL4050426 0.84 CYP2C19 (0.72) CYP2C19PTGER1PTGER4PTGER3PTGER2
SCHEMBL724648 0.84 CYP2C19 (0.72) CYP2C19PTGER1PTGER4PTGER3PTGER2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119060417-A Starch-based degradable composite material and preparation method thereof 台州黄岩泽钰新材料科技有限公司 2024-12-03 CN claimed
EP-0494131-A1 Rubber compositions providing improved rubber-vulcanisate properties MONSANTO EUROPE S.A./N.V. (BE) 1992-07-08 EP claimed
US-4177114-A PREPLATING, THIOCYANATE IONS HITACHI, LTD. (JP) 1979-12-04 US claimed
US-20250361253-A1 STING AGONIST COMPOUNDS SUTRO BIOPHARMA INC (US) 2025-11-27 US disclosed
EP-4536672-A1 STING AGONIST COMPOUNDS Sutro Biopharma, Inc. (US) 2025-04-16 EP disclosed
CN-119654330-A STING agonist compounds 苏特罗生物制药公司 2025-03-18 CN disclosed
CN-119060417-A Starch-based degradable composite material and preparation method thereof 台州黄岩泽钰新材料科技有限公司 2024-12-03 CN disclosed
EP-4425181-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE Bertis Inc (KR) 2024-09-04 EP disclosed
CN-111856881-B Photosensitive resin composition, dry film resist and corresponding element 杭州福斯特电子材料有限公司 2024-03-26 CN disclosed
CN-115869312-B PDC anti-tumor medicine and preparation method and application thereof 哈尔滨吉象隆生物技术有限公司 2024-02-27 CN disclosed
US-20240011979-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS INC. (KR) 2024-01-11 US disclosed
EP-0036991-A1 5-Alkyl-3-alkylthiopropionthioates, process for their preparation and their use as pharmaceutical compositions Troponwerke GmbH & Co. KG (DE) 1981-10-07 EP disclosed
US-4179432-A 2-HYDROXYBENZOPHENONE, ORGANOTIN MERCAPTIDE PHOTOSTABILITY CINCINNATI MILACRON CHEMICALS, INC. (US) 1979-12-18 US disclosed
US-4177114-A PREPLATING, THIOCYANATE IONS HITACHI, LTD. (JP) 1979-12-04 US disclosed
US-RE29523-E Olefinic polymers stabilized with thioacyl trivalent phosphorus compounds BORG-WARNER CORPORATION (US) 1978-01-24 US disclosed
US-4064100-A HEAT AND LIGHT STABILIZERS FOR POLYMERS, CONTAINERS FOR FOOD WESTON CHEMICAL CO., INC. (US) 1977-12-20 US disclosed
US-4031087-A INSECTICIDES SHELL OIL COMPANY (US) 1977-06-21 US disclosed
US-4012399-A ULTRAVIOLET LIGHT ABSORBERS AND STABILIZERS CINCINNATI MILACRON CHEMICALS, INC. (US) 1977-03-15 US disclosed
US-4000101-A POLYPROPYLENE WESTON CHEMICAL CORPORATION (US) 1976-12-28 US disclosed
US-3959220-A Polymer additives comprising transition metal complexes with trivalent phosphorous compounds CINCINNATI MILACRON CHEMICALS, INC. (US) 1976-05-25 US 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-20250361253-A1 STING AGONIST COMPOUNDS STING1, CGAS, MAVS CYP2C19 4741/4885PTGER1 1487/4885PTGER4 2577/4885

“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.