SCHEMBL749033

SCHEMBL749033

[O]c1ccccc1OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.59
MAPK1 P28482 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
HTR1A P08908 3/20 0.55
DRD2 P14416 1/20 0.55
ALPG P10696 1/20 0.55
PTK2B Q14289 1/20 0.55
LIPE Q05469 1/20 0.53
CCNB2 O95067 1/20 0.53
CDK1 P06493 1/20 0.53
CDK4 P11802 1/20 0.53
CCNB1 P14635 1/20 0.53
CCND1 P24385 1/20 0.53
CCNB3 Q8WWL7 1/20 0.53
LTA4H P09960 1/20 0.52
MAPK14 Q16539 1/20 0.52
ADRA1D P25100 2/20 0.50
ADRA1A P35348 2/20 0.50
ADRA1B P35368 2/20 0.50

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
SCHEMBL339812 0.84 MAPT (0.71) MAPTMAPK1TDP1L3MBTL1HTR1A
SCHEMBL23258867 0.83 MAPT (0.59) MAPTMAPK1TDP1L3MBTL1HTR1A
Formaldehyde SCHEMBL27831678 0.82 MAPT (0.63) MAPTMAPK1TDP1L3MBTL1HTR1A
SCHEMBL8130463 0.80 HTR1A (0.61) MAPK1HTR1ADRD2LTA4HMAPK14
SCHEMBL8764941 0.79 CYP11B1 (0.49) HTR1ADRD2NPC1
SCHEMBL2096056 0.79 ALOX5 (0.58) MAPTL3MBTL1LMNANPC1
SCHEMBL13434101 0.78 HTR1A (0.74) MAPTMAPK1TDP1L3MBTL1HTR1A
SCHEMBL5538708 0.77 MAPT (0.63) MAPTMAPK1TDP1L3MBTL1HTR1A
SCHEMBL26013299 0.77 MAPT (0.63) MAPTMAPK1TDP1L3MBTL1HTR1A
SCHEMBL8216313 0.77 MAPT (0.69) MAPTMAPK1TDP1L3MBTL1HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109721546-A Substituted pyrimidine aryl ester derivative and preparation method thereof, Herbicidal combinations and application 青岛清原化合物有限公司 2019-05-07 CN claimed
CN-108753182-A A kind of OCA optical cements haveing excellent performance, optical adhesive tape and preparation method thereof 广东东立新材料科技股份有限公司 2018-11-06 CN claimed
EP-1465869-B1 MODULATORS OF LXR EXELIXIS PATENT CO LLC (US) 2013-05-15 EP claimed
US-8044082-B2 N-phenylacetamide inhibitors of the enzyme SOAT-1 and pharmaceutical/cosmetic compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-10-25 US claimed
US-7998986-B2 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 US claimed
US-7547749-B2 Triazine compounds, polymers comprising triazine structural units, and method SABIC INNOVATIVE PLATICS IP B.V. (NL) 2009-06-16 US claimed
CN-101239954-A Triazine compounds and triazine compounds polymers comprising triazine structural units, and processes for the preparation of these polymers GEN ELECTRIC (US) 2008-08-13 CN claimed
US-20080097040-A1 TRIAZINE COMPOUNDS, POLYMERS COMPRISING TRIAZINE STRUCTURAL UNITS, AND METHOD GENERAL ELECTRIC COMPANY (US) 2008-04-24 US claimed
US-20070219197-A1 Pyridyl alkene and pyridyl alkine- acid amides as cytostatics and immuno-suppressives ASTELLAS PHARMA GMBH (DE) 2007-09-20 US claimed
EP-1465869-A4 MODULATORS OF LXR X CEPTOR THERAPEUTICS INC (US) 2005-12-28 EP claimed
EP-0501986-A1 ISOXAZOLINES, METHOD OF PREPARATION THEREOF, AND THEIR USE AS PLANT-PROTECTION AGENTS Hoechst Schering AgrEvo GmbH (DE) 1992-09-09 EP claimed
WO-1992003053-A1 PLANT PROTECTING AGENTS CONTAINING ISOXAZOLINE OR ISOTHIAZOLINE AND NEW ISOXAZOLINES AND ISOTHIAZOLINES HOECHST AKTIENGESELLSCHAFT (DE) 1992-03-05 WO claimed
CN-1059072-A Contain the plant protection preparation of different  azoles quinoline or isothiazoline and new different  azoles quinoline class and isothiazoline compounds HOECHST AG (DE) 1992-03-04 CN claimed
CN-1058968-A Plant protection product, its preparation method and application HOECHST AG (DE) 1992-02-26 CN claimed
WO-1991018907-A1 PLANT-PROTECTING SUBSTITUTED ISOXAZOLINES, ISOXAZOLES, ISOTHIAZOLINES AND ISOTHIAZOLES, PROCESS FOR PRODUCING THEM AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1991-12-12 WO claimed
CN-1052308-A Different  azoles quinoline, its preparation method and as the application of plant protection product HOECHST AG (DE) 1991-06-19 CN claimed
WO-1991008202-A1 ISOXAZOLINES, METHOD OF PREPARATION THEREOF, AND THEIR USE AS PLANT-PROTECTION AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1991-06-13 WO claimed
US-4713471-A REACTING BENZYLOXYPHENOLS WITH HALOBUTANONES AND THEN WITH DIALKYL CARBONATES STAUFFER CHEMICAL COMPANY (US) 1987-12-15 US claimed
EP-0118685-A1 Propene derivatives and their use as plant growth inhibitors DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1984-09-19 EP claimed
EP-0117412-A1 Propene derivatives and their use as plant growth inhibitors DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1984-09-05 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-20070219197-A1 Pyridyl alkene and pyridyl alkine- acid amides as cytostatics and immuno-suppressives NFATC1, PDCD1, ACIN1 MAPT 4047/4885MAPK1 1530/4885TDP1 1766/4885

“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.