SCHEMBL498622

SCHEMBL498622

CCc1cccc2cc3ccccc3cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
GAA P10253 1/20 0.46
CYP1A2 P05177 2/20 0.43
CYP2A6 P11509 1/20 0.43
GABRA1 P14867 2/20 0.43
GABRB2 P47870 2/20 0.43
DAO P14920 2/20 0.40
DDO Q99489 1/20 0.40
NQO2 P16083 1/20 0.40
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
HIF1A Q16665 1/20 0.39
CYP1B1 Q16678 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MTNR1A P48039 1/20 0.39
NR1I2 O75469 1/20 0.39
MAPT P10636 1/20 0.39
HTR2A P28223 1/20 0.39
NQO1 P15559 1/20 0.39

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
SCHEMBL31158567 0.98 ALDH1A1 (0.44) ALDH1A1KDM4EGAACYP1A2CYP2A6
Hydrogen Peroxide SCHEMBL28103162 0.96 KDM4E (0.47) ALDH1A1KDM4EGAACYP1A2CYP2A6
SCHEMBL544574 0.94 ALDH1A1 (0.47) ALDH1A1KDM4EGAACYP1A2CYP2A6
SCHEMBL2987953 0.92 ALDH1A1 (0.46) ALDH1A1KDM4EGAACYP1A2CYP2A6
Formic Acid SCHEMBL29102709 0.91 KDM4E (0.43) ALDH1A1KDM4EGAACYP1A2CYP2A6
Hydroquinone SCHEMBL28096382 0.91 GABRA1 (0.45) ALDH1A1KDM4EGAACYP1A2GABRA1
Ether SCHEMBL28163199 0.86 ALDH1A1 (0.41) ALDH1A1KDM4EGAACYP1A2CYP2A6
SCHEMBL6889822 0.85 CYP1A2 (0.58) ALDH1A1KDM4EGAACYP1A2CYP2A6
SCHEMBL481418 0.84 CYP1A2 (0.44) ALDH1A1KDM4EGAACYP1A2CYP2A6
SCHEMBL10984867 0.84 CYP2A6 (0.48) ALDH1A1KDM4EGAACYP1A2CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120149327-A Solid composite alkali metal negative electrode, preparation method thereof and secondary battery 中国科学院苏州纳米技术与纳米仿生研究所 2025-06-13 CN claimed
CN-119119042-A Near-infrared response type asymmetric polymethine cyanine dye, and preparation method and application thereof 大连理工大学 2024-12-13 CN claimed
CN-107746372-A Production process of 2-ethyl anthraquinone 钦州学院 2018-03-02 CN claimed
US-20150322308-A1 EPOXY RESIN, PRODUCTION METHOD THEREOF, EPOXY RESIN COMPOSITION, AND CURED PRODUCT MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2015-11-12 US claimed
EP-2865695-A1 EPOXY RESIN, METHOD FOR PRODUCING SAME, EPOXY RESIN COMPOSITION, AND CURED PRODUCT Mitsubishi Gas Chemical Company, Inc. (JP) 2015-04-29 EP claimed
CN-104395370-A Epoxy resin, method for producing same, epoxy resin composition, and cured product MITSUBISHI GAS CHEMICAL CO 2015-03-04 CN claimed
CN-103848401-A Preparing method of hydrogen peroxide MITSUBISHI GAS CHEMICAL CO 2014-06-11 CN claimed
US-8536395-B2 Catalyst with an ion-modified binder FINA TECHNOLOGY, INC. (US) 2013-09-17 US claimed
US-20120095250-A1 CATALYST WITH AN ION-MODIFIED BINDER FINA TECHNOLOGY, INC. (US) 2012-04-19 US claimed
CN-101322267-A Anode for biological power generation and power generation method and device utilizing it EBARA CORP (JP) 2008-12-10 CN claimed
CN-101317297-A Biological power generation device, method for treating waste containing organic solid pollutants, method for treating waste liquid containing organic polymer, method for treating waste liquid containing organic substances, and device for implementing the treatment methods EBARA CORP (JP) 2008-12-03 CN claimed
US-5440062-A One-(substituted)amino-7-(substituted)imino-1,3,5-cycloheptatriene-metal complexes as catalysts MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1995-08-08 US claimed
US-4962214-A COPPER AMINOTROPONEIMINE COMPLEX CATALYSTS MASSACHUSETTES INSTITUTE OF TECHNOLOGY (US) 1990-10-09 US claimed
WO-1989010916-A1 ENANTIOSELECTIVE ADDITION OF HYDROCARBONS TO ALPHA,BETA-UNSATURATED CARBONYL COMPOUNDS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1989-11-16 WO claimed
WO-2026099510-A1 RESILIENT MARKER COMPOUNDS MINTON, TREHARNE & DAVIES LIMITED (GB) 2026-05-15 WO disclosed
US-20260035557-A1 THERMOSETTING RESIN COMPOSITION, CURED PRODUCT OF SAME, PREPREG, FIBER-REINFORCED COMPOSITE MATERIAL, AND HIGH-PRESSURE GAS CONTAINER MITSUBISHI GAS CHEMICAL CO (JP) 2026-02-05 US disclosed
EP-4431541-B1 EMULSION-TYPE EPOXY RESIN COMPOSITION, METHOD FOR PRODUCING SAME, AND COATING MATERIAL MITSUBISHI GAS CHEMICAL CO (JP) 2025-12-24 EP disclosed
EP-0005310-A1 Process for preparing dialkylphosphorochloridothioates, the use of the so prepared compounds as intermediates, and the use of some of the final products as insecticides ETHYL CORPORATION (US) 1979-11-14 EP disclosed
US-4159289-A FROM PHOSPHORUS PENTASULFIDE AND AN ALKANOL WITH SUBSEQUENT CHLORINATION, DISTILLATION, SOLUBILIZING SULFUR BY-PRODUCT USING HYDROCARBON ETHYL CORPORATION (US) 1979-06-26 US disclosed
US-4131646-A Preparation of hydrogen peroxide from dihydroanthracene hydroperoxides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-12-26 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-20260035557-A1 THERMOSETTING RESIN COMPOSITION, CURED PRODUCT OF SAME, PREPREG, FIBER-REINFORCED COMPOSITE MATERIAL, AND HIGH-PRESSURE GAS CONTAINER PARG, COPG2, ARFGAP1 ALDH1A1 3024/4885KDM4E 2714/4885GAA 2566/4885

“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.