SCHEMBL9716759

SCHEMBL9716759

OCc1cc(-c2ccccc2)ccc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.61
ALOX5 P09917 1/20 0.59
CYP1A2 P05177 1/20 0.59
ALDH1A1 P00352 2/20 0.53
LMNA P02545 2/20 0.53
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
USP2 O75604 1/20 0.53
HSP90AA1 P07900 1/20 0.53
GAA P10253 1/20 0.53
MAPT P10636 1/20 0.53
HPGD P15428 1/20 0.53
ALOX15 P16050 1/20 0.53
ALOX12 P18054 1/20 0.53
HTT P42858 1/20 0.53
KMT2A Q03164 1/20 0.53
HSD17B10 Q99714 1/20 0.53
ESR2 Q92731 1/20 0.53
ACMSD Q8TDX5 4/20 0.50
HNF4A P41235 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
SCHEMBL9418406 0.89 GABRA1 (0.56) BACE1ALOX5CYP1A2GABRA1GABRB2
SCHEMBL50409 0.85 BACE1 (0.62) BACE1ALOX5CYP1A2ALDH1A1LMNA
SCHEMBL29059236 0.83 ALOX5 (0.59) BACE1ALOX5CYP1A2ALDH1A1LMNA
SCHEMBL3148557 0.83 DCLRE1A (0.47) BACE1ALOX5CYP1A2ALDH1A1LMNA
SCHEMBL4816628 0.82 GABRA1 (0.46) BACE1ALOX5CYP1A2ALDH1A1MEN1
SCHEMBL9828428 0.82 BACE1 (0.59) BACE1ALOX5CYP1A2ALDH1A1LMNA
SCHEMBL1023129 0.82 HSD17B1 (0.66) BACE1ALOX5CYP1A2ALDH1A1LMNA
SCHEMBL19117351 0.81 MCL1 (0.47) BACE1ALOX5CYP1A2MEN1GAA
SCHEMBL29738649 0.80 MEN1 (0.62) BACE1ALOX5CYP1A2ALDH1A1LMNA
SCHEMBL8992573 0.80 MEN1 (0.62) BACE1ALOX5CYP1A2ALDH1A1LMNA

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110194829-B Preparation method of high-refractive-index PU (polyurethane) modified polysiloxane 广东工业大学 2021-10-26 CN claimed
US-20200331828-A1 NOVEL COMPOUNDS WHICH ACTIVATE ESTROGEN RECEPTORS AND COMPOSITIONS AND METHODS OF USING THE SAME UNIV ILLINOIS (US) 2020-10-22 US disclosed
US-20200331828-A1 NOVEL COMPOUNDS WHICH ACTIVATE ESTROGEN RECEPTORS AND COMPOSITIONS AND METHODS OF USING THE SAME UNIV ILLINOIS (US) 2020-10-22 US disclosed
US-10703698-B2 Compounds which activate estrogen receptors and compositions and methods of using the same THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2020-07-07 US disclosed
US-10703698-B2 Compounds which activate estrogen receptors and compositions and methods of using the same THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2020-07-07 US disclosed
US-20190002380-A1 NOVEL COMPOUNDS WHICH ACTIVATE ESTROGEN RECEPTORS AND COMPOSITIONS AND METHODS OF USING THE SAME THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2019-01-03 US disclosed
US-20190002380-A1 NOVEL COMPOUNDS WHICH ACTIVATE ESTROGEN RECEPTORS AND COMPOSITIONS AND METHODS OF USING THE SAME THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2019-01-03 US disclosed
EP-3400071-A1 NOVEL COMPOUNDS WHICH ACTIVATE ESTROGEN RECEPTORS AND COMPOSITIONS AND METHODS OF USING THE SAME The Board of Trustees of the University of Illinois (US) 2018-11-14 EP disclosed
WO-2017120507-A1 NOVEL COMPOUNDS WHICH ACTIVATE ESTROGEN RECEPTORS AND COMPOSITIONS AND METHODS OF USING THE SAME THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-07-13 WO disclosed
WO-2017120507-A1 NOVEL COMPOUNDS WHICH ACTIVATE ESTROGEN RECEPTORS AND COMPOSITIONS AND METHODS OF USING THE SAME THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-07-13 WO disclosed
EP-0273980-B1 CAN WITH AN EASILY OPENABLE LID AND A PROCESS FOR PRODUCING THE SAME TOYO SEIKAN KAISHA, LTD. (JP) 1992-02-19 EP disclosed
US-4916031-A HYDROXYMETHYLPHENOL PRIMER TOYO SEIKAN KAISHA, LTD. (JP) 1990-04-10 US disclosed
US-4891297-A STORAGE STABILITY, HIGH COLOR DENSITY FUJI PHOTO FILM CO.,LTD. (JP) 1990-01-02 US disclosed
US-4828136-A CORROSION AND HOT WATER RESISTANCE TOYO SEIKAN KAISHA, LTD. (JP) 1989-05-09 US disclosed
EP-0273980-A1 CAN WITH AN EASILY OPENABLE LID AND A PROCESS FOR PRODUCING THE SAME TOYO SEIKAN KAISHA, LTD. (JP) 1988-07-13 EP disclosed
US-4701354-A VAPOR DEPOSITION OF AN HYDROXYMETHYL SUBSTITUTED PHENOL TOYO SEIKAN KAISHA, LTD. (JP) 1987-10-20 US disclosed
US-3741985-A PHENYL-BENZODIOXANE DERIVATIVES SYNTEX CORP 1973-06-26 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 (3 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-10703698-B2 Compounds which activate estrogen receptors and compositions and methods of using the same GPER1, ESRRG, ESR2 BACE1 1118/4885ALOX5 261/4885CYP1A2 613/4885
US-20190002380-A1 NOVEL COMPOUNDS WHICH ACTIVATE ESTROGEN RECEPTORS AND COMPOSITIONS AND METHODS OF USING THE SAME GPER1, ESRRG, ESR2 BACE1 1025/4885ALOX5 265/4885CYP1A2 493/4885
US-20200331828-A1 NOVEL COMPOUNDS WHICH ACTIVATE ESTROGEN RECEPTORS AND COMPOSITIONS AND METHODS OF USING THE SAME GPER1, ESRRG, ESR2 BACE1 1025/4885ALOX5 265/4885CYP1A2 493/4885

“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.