SCHEMBL2160963

SCHEMBL2160963

C/C=C/CCC(C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.54
GABRR1 P24046 2/20 0.48
LTA4H P09960 1/20 0.42
BLM P54132 1/20 0.42
ACE2 Q9BYF1 1/20 0.39
GRIK1 P39086 2/20 0.37
GRIK2 Q13002 2/20 0.37
PPARG P37231 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
ARG2 P78540 1/20 0.34
NAALAD2 Q9Y3Q0 2/20 0.34
FOLH1 Q04609 1/20 0.33

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
SCHEMBL8632405 1.00 CYP1A2 (0.54) CYP1A2GABRR1LTA4HBLMACE2
SCHEMBL2160966 1.00 CYP1A2 (0.54) CYP1A2GABRR1LTA4HBLMACE2
SCHEMBL13384365 1.00 CYP1A2 (0.54) CYP1A2GABRR1LTA4HBLMACE2
Hydrochloric Acid SCHEMBL28546455 0.98 CYP1A2 (0.52) CYP1A2GABRR1LTA4HBLMACE2
SCHEMBL5407252 0.88 GABRR1 (0.54) CYP1A2GABRR1LTA4HBLMACE2
SCHEMBL5407249 0.88 GABRR1 (0.54) CYP1A2GABRR1LTA4HBLMACE2
SCHEMBL7253734 0.87 CYP1A2 (0.50) CYP1A2GABRR1LTA4HBLMACE2
SCHEMBL7253732 0.87 CYP1A2 (0.50) CYP1A2GABRR1LTA4HBLMACE2
SCHEMBL21595291 0.85 LTA4H (0.52) CYP1A2GABRR1LTA4HBLMACE2
SCHEMBL21595289 0.85 LTA4H (0.52) CYP1A2GABRR1LTA4HBLMACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250382273-A1 BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS INST NAT SANTE RECH MED (FR) 2025-12-18 US claimed
CN-117720452-A Preparation method of 3-aza-tricyclo [4.2.1.0 (2.5) ] nonane-7-ene-4-one 成都科圣原医药科技有限公司 2024-03-19 CN claimed
WO-2024011345-A1 LAUNDRY DETERGENT COMPOSITION CONTAINING GRAFT COPOLYMER AND BENEFIT AGENT THE PROCTER & GAMBLE COMPANY (US) 2024-01-18 WO claimed
CN-113797969-B Preparation method of single-molecule nano micelle suitable for acid-base tandem catalysis 浙江理工大学绍兴柯桥研究院有限公司 2023-10-03 CN claimed
CN-116601185-A Olefin composition comprising hydrocarbon resin 马特里亚公司 2023-08-15 CN claimed
CN-116568263-A Hair care composition comprising malodor reduction materials 宝洁公司 2023-08-08 CN claimed
CN-116500858-A Coating of combined photoresist and Si-based hard mask 上海艾深斯科技有限公司 2023-07-28 CN claimed
CN-116217400-A Cypress aroma compound and preparation method thereof 波顿香料股份有限公司 2023-06-06 CN claimed
CN-112778156-B Bishydrazide structure compound, preparation method and application thereof 中国科学院上海药物研究所 2023-03-14 CN claimed
CN-109313388-B Negative photosensitive composition 住友电木株式会社 2022-06-21 CN claimed
CN-114195986-A Method for preparing polyolefin by metal-catalyzed ring-opening metathesis polymerization 南京先进生物材料与过程装备研究院有限公司 2022-03-18 CN claimed
CN-113797969-A Preparation method of monomolecular nano micelle suitable for acid-base tandem catalysis 浙江理工大学绍兴柯桥研究院有限公司 2021-12-17 CN claimed
CN-113582980-A Compound based on heterocyclic ring and glutarimide framework and application thereof 上海科技大学 2021-11-02 CN claimed
CN-113423702-A N- (pyridin-2-yl) pyridine-sulfonamide derivatives and their use in the treatment of disease 诺华股份有限公司 2021-09-21 CN claimed
CN-112778156-A Bishydrazide structure compound, preparation method and application thereof 中国科学院上海药物研究所 2021-05-11 CN claimed
CN-112739803-A Fragrance composition containing norbornene derivative 普罗米鲁斯有限责任公司 2021-04-30 CN claimed
CN-105899651-B Benefit agent containing delivery particles based on styrene maleic anhydride copolymers 宝洁公司 2020-02-07 CN claimed
EP-1061894-A1 FRAGRANCE ENHANCING COMPOSITIONS FOR COSMETIC PRODUCTS Colgate-Palmolive Company (US) 2000-12-27 EP claimed
WO-1999044575-A1 FRAGRANCE ENHANCING COMPOSITIONS FOR COSMETIC PRODUCTS COLGATE-PALMOLIVE COMPANY (US) 1999-09-10 WO claimed
EP-0071571-B1 PHOTOPOLYMERISATION PROCESS CIBA-GEIGY AG (CH) 1985-09-04 EP 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 (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-20250382273-A1 BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS BBOX1, NDUFB6, NDUFB5 CYP1A2 57/4885GABRR1 3186/4885LTA4H 324/4885

“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.