SCHEMBL171209

SCHEMBL171209

Cc1cc2ccccc2cc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.52
ALDH1A1 P00352 2/20 0.52
HPGD P15428 2/20 0.52
CYP1A2 P05177 2/20 0.52
MAPT P10636 2/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
G6PD P11413 1/20 0.52
CYP2C9 P11712 1/20 0.52
PKM P14618 1/20 0.52
ALOX15 P16050 1/20 0.52
ALOX12 P18054 1/20 0.52
MAPK1 P28482 1/20 0.52
CYP2C19 P33261 1/20 0.52
CCR6 P51684 1/20 0.52
HIF1A Q16665 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
HSD17B10 Q99714 1/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 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
SCHEMBL6282738 0.83 KDM4E (0.55) KDM4EALDH1A1HPGDCYP1A2MAPT
SCHEMBL13255969 0.83 KDM4E (0.55) KDM4EALDH1A1HPGDCYP1A2MAPT
SCHEMBL12962952 0.80 KDM4E (0.52) KDM4EALDH1A1HPGDCYP1A2MAPT
SCHEMBL29363675 0.80 TRPM4 (0.57) KDM4EALDH1A1HPGDCYP1A2MAPT
SCHEMBL28653 0.80 TRPM4 (0.57) KDM4EALDH1A1HPGDCYP1A2MAPT
SCHEMBL29518518 0.80 CYP2A6 (0.55) ALDH1A1CYP1A2ALOX12TDP1CYP2A6
SCHEMBL234439 0.80 CYP2A6 (0.55) ALDH1A1CYP1A2ALOX12TDP1CYP2A6
SCHEMBL29750056 0.80 TRPM4 (0.57) KDM4EALDH1A1HPGDCYP1A2MAPT
SCHEMBL15093210 0.80 LMNA (0.46) KDM4EALDH1A1HPGDCYP1A2MAPT
SCHEMBL11753298 0.78 CYP1A2 (0.59) KDM4EALDH1A1HPGDCYP1A2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9173892-B2 Acadesine derivatives, products and compositions including same, therapeutic uses thereof, and methods for synthesizing same UNIVERSITE NICE SOPHIA ANTIPOLIS (FR) 2015-11-03 US claimed
EP-2699240-B1 ACADESINE DERIVATIVES, PRODUCTS AND COMPOSITIONS INCLUDING SAME, THERAPEUTIC USES THEREOF, AND METHODS FOR SYNTHESIZING SAME UNIVERSITÉ NICE SOPHIA ANTIPOLIS (FR) 2015-05-27 EP claimed
US-20140312270-A1 Use of Carbonium Ion Scavengers in the Treatment of Lignocellulosic Biomass ETH ZURICH (CH) 2014-10-23 US claimed
EP-2776620-A1 USE OF CARBONIUM ION SCAVENGERS IN THE TREATMENT OF LIGNOCELLULOSIC BIOMASS ETH Zürich (CH) 2014-09-17 EP claimed
US-20140179626-A1 ACADESINE DERIVATIVES, PRODUCTS AND COMPOSITIONS INCLUDING SAME, THERAPUETIC USES THEREOF, AND METHODS FOR SYNTHESIZING SAME INSTITUT NATIONAL DE LA SANTE DE LA RECHERCHE MEDICALE (FR) 2014-06-26 US claimed
CN-103619332-A Acadesine derivatives, products and compositions including same, therapeutic uses thereof, and methods for synthesizing same UNIV NICE SOPHIA ANTIPOLIS 2014-03-05 CN claimed
WO-2013068092-A1 USE OF CARBONIUM ION SCAVENGERS IN THE TREATMENT OF LIGNOCELLULOSIC BIOMASS ETH ZURICH (CH) 2013-05-16 WO claimed
EP-1404763-B8 METHOD FOR THE PRODUCTION OF PLANE-PARALLEL PLATELETS BY USING ORGANIC SEPARATING AGENTS CIBA SC HOLDING AG (CH) 2007-10-10 EP claimed
EP-1404763-A1 METHOD FOR THE PRODUCTION OF PLANE-PARALLEL PLATELETS BY USING ORGANIC SEPARATING AGENTS Ciba Specialty Chemicals Holding Inc. (CH) 2004-04-07 EP claimed
WO-2002094945-A1 METHOD FOR THE PRODUCTION OF PLANE-PARALLEL PLATELETS BY USING ORGANIC SEPARATING AGENTS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2002-11-28 WO claimed
US-12187681-B2 Ion channel antagonists/blockers and uses thereof SHANGHAI EAST HOSPITAL (CN) 2025-01-07 US disclosed
WO-2024147153-A1 PEPTIDE-HISTIDINAL CONJUGATES AS AN ANTI-MALARIAL AGENTS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2024-07-11 WO disclosed
WO-2024145053-A1 TYRAMIDE AND TYRAMIDE ANALOG CONJUGATES AND USES THEREOF FOR BIOLOGICAL TARGET STAINING PROCEDURES Life Technologies Corporation (US) 2024-07-04 WO disclosed
CN-114401935-B Ion channel antagonists/blockers and uses thereof 上海市东方医院(同济大学附属东方医院) 2024-04-05 CN disclosed
CN-117486682-A Preparation method of functionalized beta-naphthalenyl ether compound 中国海洋石油集团有限公司 2024-02-02 CN disclosed
EP-1186962-A2 Toner CANON KABUSHIKI KAISHA (JP) 2002-03-13 EP disclosed
US-6132640-A ZINC COMPLEXES OF QUINOLINE MITSUI CHEMICALS, INC. (JP) 2000-10-17 US disclosed
US-6106999-A SENSITIVITY TO GENERAL-PURPOSE VISIBLE LIGHT LASER, SO THAT HIGH-SPEED SCANNING EXPOSURE IS POSSIBLE BY LASER, AND EXTREMELY FINE HIGH RESOLUTION CAN BE OBTAINED; CAN BE USED FOR COATING OR PRINTING UNDER SAFELIGHT IRRADIATING CONDITIONS MITSUI CHEMICALS (JP) 2000-08-22 US disclosed
EP-0818512-A1 Quinoline derivative and use of same MITSUI TOATSU CHEMICALS, Inc. (JP) 1998-01-14 EP disclosed
US-4560810-A CHROMIUM OXIDE CATALYST CONTAINING AN OXIDE OF ZINC,IRON, MAGNESIUM, OR MANGANESE GENERAL ELECTRIC COMPANY (US) 1985-12-24 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 (2 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-12187681-B2 Ion channel antagonists/blockers and uses thereof CACNA1F, CACNA1S, CACNA1D KDM4E 3795/4885ALDH1A1 1001/4885HPGD 633/4885
US-20140179626-A1 ACADESINE DERIVATIVES, PRODUCTS AND COMPOSITIONS INCLUDING SAME, THERAPUETIC USES THEREOF, AND METHODS FOR SYNTHESIZING SAME MCL1, ALOX15, ALOX12 KDM4E 2715/4885ALDH1A1 1038/4885HPGD 45/4885

“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.