SCHEMBL597668

SCHEMBL597668

CCCCc1ccc2ccccc2c1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.65
CYP1A2 P05177 2/20 0.63
CYP2A6 P11509 1/20 0.63
BCHE P06276 3/20 0.59
HDAC1 Q13547 1/20 0.50
PSMB5 P28074 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HRH3 Q9Y5N1 1/20 0.49
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HTR2B P41595 1/20 0.48
SKP2 Q13309 1/20 0.48

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
SCHEMBL29663820 1.00 SIGMAR1 (0.65) SIGMAR1CYP1A2CYP2A6BCHEHDAC1
Methane SCHEMBL27919139 0.96 SIGMAR1 (0.61) SIGMAR1CYP1A2CYP2A6BCHEHDAC1
SCHEMBL2480738 0.94 SIGMAR1 (0.58) SIGMAR1CYP1A2CYP2A6BCHEHDAC1
SCHEMBL27595226 0.94 SIGMAR1 (0.58) SIGMAR1CYP1A2CYP2A6BCHEHDAC1
SCHEMBL598156 0.94 SIGMAR1 (0.62) SIGMAR1CYP1A2CYP2A6BCHEHDAC1
SCHEMBL598951 0.92 SIGMAR1 (0.61) SIGMAR1CYP1A2CYP2A6BCHEHDAC1
SCHEMBL9299473 0.92 SIGMAR1 (0.61) SIGMAR1CYP1A2CYP2A6BCHEHDAC1
SCHEMBL598910 0.92 SIGMAR1 (0.61) SIGMAR1CYP1A2CYP2A6BCHEHDAC1
SCHEMBL6066140 0.92 SIGMAR1 (0.61) SIGMAR1CYP1A2CYP2A6BCHEHDAC1
SCHEMBL31490433 0.92 SIGMAR1 (0.61) SIGMAR1CYP1A2CYP2A6BCHEHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12441901-B2 Quantum dot ink composition, and quantum dot electroluminescent device SAMSUNG ELECTRONICS CO., LTD. (KR) 2025-10-14 US claimed
CN-119758495-A Insulating liquid, high-reliability liquid lens and application thereof 上海酷聚科技有限公司 2025-04-04 CN claimed
CN-116606568-A Quantum dot ink composition and quantum dot electroluminescent device 三星电子株式会社 2023-08-18 CN claimed
US-20230257607-A1 QUANTUM DOT INK COMPOSITION, AND QUANTUM DOT ELECTROLUMINESCENT DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-08-17 US claimed
US-4225747-A Submarine electric power cables containing naphthalene based liquids INDUSTRIE PIRELLI SOCIETA PER AZIONI (IT) 1980-09-30 US claimed
US-12540073-B2 Heterogeneous hydrogen-catalyst solid fuel reaction mixture and reactor BRILLIANT LIGHT POWER, INC. (US) 2026-02-03 US disclosed
US-12441901-B2 Quantum dot ink composition, and quantum dot electroluminescent device SAMSUNG ELECTRONICS CO., LTD. (KR) 2025-10-14 US disclosed
CN-119758495-A Insulating liquid, high-reliability liquid lens and application thereof 上海酷聚科技有限公司 2025-04-04 CN disclosed
CN-119256643-A Method for printing functional layers of electronic devices by combining inks 默克专利有限公司 2025-01-03 CN disclosed
US-20240407250-A1 COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, METHOD FOR PRODUCING ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND ILLUMINATOR MITSUBISHI CHEMICAL CORPORATION (JP) 2024-12-05 US disclosed
CN-118908981-A Method for producing organometallic nucleophile and reaction method using organometallic nucleophile 国立大学法人北海道大学 2024-11-08 CN disclosed
US-20240244957-A1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL Merck Patent KGaA (DE) 2024-07-18 US disclosed
EP-0757985-A1 N-(3-PYRROLIDINYL)BENZAMIDE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1997-02-12 EP disclosed
EP-0749966-A1 5-HT 3 RECEPTOR AGONIST, NOVEL THIAZOLE DERIVATIVE, AND INTERMEDIATE THEREFOR YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-12-27 EP disclosed
EP-0733364-A1 MEDICINAL COMPOSITION FOR CIRCULATORY ORGAN NIPPON SHINYAKU COMPANY, LIMITED (JP) 1996-09-25 EP disclosed
EP-0731146-A2 Cationic dyes, their production and use Clariant Finance (BVI) Limited (VG) 1996-09-11 EP disclosed
EP-0425134-A1 Condensed pyrrolo derivatives, process for their preparation and pharmaceutical compositions containing them YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1991-05-02 EP disclosed
US-4987132-A PLATELET ACTIVATING FACTOR ANTAGONISTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-01-22 US disclosed
EP-0346847-A2 Amino acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1989-12-20 EP disclosed
US-4039793-A PRODUCTION OF MONOCHLORO- AND ARYL SUBSTITUTED SATURATED COMPOUNDS UOP INC. (US) 1977-08-02 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-12540073-B2 Heterogeneous hydrogen-catalyst solid fuel reaction mixture and reactor SCO2, SOD1, HAO2 SIGMAR1 2882/4885CYP1A2 1592/4885CYP2A6 4027/4885

“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.