SCHEMBL164545

SCHEMBL164545

CCCCCC/C=C\CCCCCCCc1cc(O)cc(O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CBS P35520 1/20 0.79
PTGS2 P35354 5/20 0.79
CYP3A4 P08684 2/20 0.75
ESR1 P03372 2/20 0.52
ADRA2A P08913 2/20 0.52
ADORA3 P0DMS8 2/20 0.52
TACR2 P21452 2/20 0.52
SLC6A2 P23975 2/20 0.52
SLC6A4 P31645 2/20 0.52
SLC6A3 Q01959 2/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
SHBG P04278 1/20 0.52
TP53 P04637 1/20 0.52
HSPD1 P10809 1/20 0.52
ADRB3 P13945 1/20 0.52
HTR2C P28335 1/20 0.52
HSPE1 P61604 1/20 0.52
HIF1A Q16665 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
SCHEMBL31545119 1.00 CBS (0.79) CBSPTGS2CYP3A4ESR1ADRA2A
SCHEMBL31544940 1.00 CBS (0.79) CBSPTGS2CYP3A4ESR1ADRA2A
SCHEMBL31545757 1.00 CBS (0.79) CBSPTGS2CYP3A4ESR1ADRA2A
SCHEMBL31544853 1.00 CBS (0.79) CBSPTGS2CYP3A4ESR1ADRA2A
SCHEMBL9472976 1.00 CBS (0.79) CBSPTGS2CYP3A4ESR1ADRA2A
SCHEMBL31544875 1.00 CBS (0.79) CBSPTGS2CYP3A4ESR1ADRA2A
SCHEMBL31545471 1.00 CBS (0.79) CBSPTGS2CYP3A4ESR1ADRA2A
SCHEMBL31545637 1.00 CBS (0.79) CBSPTGS2CYP3A4ESR1ADRA2A
SCHEMBL31544858 1.00 CBS (0.79) CBSPTGS2CYP3A4ESR1ADRA2A
SCHEMBL31546072 1.00 CBS (0.79) CBSPTGS2CYP3A4ESR1ADRA2A

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 1233 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4674894-A2 COPOLYMERS OF N-VINYLPYRROLIDONE WITH FUNCTIONALIZED MALEIC ACID MOIETIES Hemoteq AG (DE) 2026-01-07 EP claimed
EP-4663688-A2 CROSSLINKERS Hemoteq AG (DE) 2025-12-17 EP claimed
EP-4627920-A1 BINARY INSECTICIDE COMPOSITION AND USE THEREOF Shenyang Sinochem Agrochemicals R & D Co., Ltd. (CN) 2025-10-08 EP claimed
US-12426782-B2 Systems and temporal alignment methods for evaluation of gestational age and time to delivery THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2025-09-30 US claimed
EP-3807287-B1 METAL COMPLEXES OF BETA-DIKETONES AND/OR POLYPHENOLS BY GREEN CHEMISTRY, PREPARATION METHOD THEREOF, SUNSCREEN THEREOF, SKIN OR HAIR TONE CONCEALER THEREOF, HAIR DYEING THEREOF AND OTHER USES THEREOF RAMIREZ RIOS LILIANA PATRICIA (NL) 2025-07-30 EP claimed
US-20240315965-A1 COMPOSITIONS AND METHODS RELATED TO PHARMACEUTICAL EXCIPIENTS Natural Extraction Systems, LLC (US) 2024-09-26 US claimed
US-20240226517-A9 DRUG-LOADED MEDICAL INSTRUMENT AND PREPARATION METHOD THEREFOR SHANGHAI MICROPORT MEDICAL (GROUP) CO., LTD. (CN) 2024-07-11 US claimed
US-20240131311-A1 DRUG-LOADED MEDICAL INSTRUMENT AND PREPARATION METHOD THEREFOR SHANGHAI MICROPORT MEDICAL GROUP CO LTD (CN) 2024-04-25 US claimed
EP-4295891-A1 DRUG-LOADED MEDICAL INSTRUMENT AND PREPARATION METHOD THEREFOR Shanghai MicroPort Medical (Group) Co., Ltd. (CN) 2023-12-27 EP claimed
US-20230089351-A1 METHODS RELATED TO BIOACTIVE AGENTS THAT CONVERT FROM ANIONS TO MOLECULES Natural Extraction Systems, LLC (US) 2023-03-23 US claimed
WO-2005122670-A2 BIOMONITORED SYNTHESIS ROUTE FOR LARGE SCALE PREPARATION OF CARDOL (BILOBOL) AND 11Δ-CARDOL KARDOL INDÚSTRIA QUÍMICA LTDA. (BR) 2005-12-29 WO claimed
WO-2005082434-A2 BIOCOMPATIBLE COATING, METHOD, AND USE OF MEDICAL SURFACES HEMOTEQ GMBH (DE) 2005-09-09 WO claimed
US-20050176678-A1 Oligosaccharide or polysaccharide which contain sugar segments; antiproliferative agents; antiinflammatory agents; anticoagulants HEMOTEQ AG (DE) 2005-08-11 US claimed
US-20050129731-A1 Biocompatible, biostable coating of medical surfaces HEMOTEQ AG (DE) 2005-06-16 US claimed
WO-2005032611-A2 BIOCOMPATIBLE, BIOSTABLE COATING OF MEDICAL SURFACES HEMOTEQ GMBH (DE) 2005-04-14 WO claimed
US-20050060028-A1 Blood biocompatible layer and adjacent layer containing antiproliferative, antiinflammatory and/or antithrombotic active agent covalently and/or adhesively bound HEMOTEQ AG (DE) 2005-03-17 US claimed
EP-1501565-A1 COMPOUNDS AND METHOD FOR COATING SURFACES IN A HAEMOCOMPATIBLE MANNER Hemoteq GmbH (DE) 2005-02-02 EP claimed
CN-1568166-A Coated stent for preventing restenosis HEMOTEQ GMBH (DE) 2005-01-19 CN claimed
CN-1552686-A Artificial compounds of 2-hydroxydiphenylketone and 4-hydroxytetraphenyl ketone and their derivatives as antiseptic bactericide 国家农产品保鲜工程技术研究中心(天 2004-12-08 CN claimed
WO-2003094990-A1 COMPOUNDS AND METHOD FOR COATING SURFACES IN A HAEMOCOMPATIBLE MANNER HEMOTEQ GMBH (DE) 2003-11-20 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20230089351-A1 METHODS RELATED TO BIOACTIVE AGENTS THAT CONVERT FROM ANIONS TO MOLECULES FABP2, FABP4, GUSB CBS 1497/4885PTGS2 1452/4885CYP3A4 3571/4885
US-20050176678-A1 Oligosaccharide or polysaccharide which contain sugar segments; antiproliferative agents; antiinflammatory agents; anticoagulants FUT5, CSGALNACT1, FUT6 CBS 2375/4885PTGS2 389/4885CYP3A4 4298/4885
US-20050129731-A1 Biocompatible, biostable coating of medical surfaces MSR1, CD44, PIGS CBS 628/4885PTGS2 328/4885CYP3A4 3072/4885

“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.