SCHEMBL6058734

SCHEMBL6058734

CC(C)(C)[Si](Oc1ccc(Br)cc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
KDM4E B2RXH2 1/20 0.37
TDP1 Q9NUW8 1/20 0.34
MAPK1 P28482 1/20 0.34
TSHR P16473 1/20 0.33
SLC6A4 P31645 2/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
ACP1 P24666 1/20 0.32
MCL1 Q07820 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
PKM P14618 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A3 Q01959 1/20 0.32
RECQL P46063 1/20 0.31
HPGD P15428 1/20 0.31
LDHA P00338 1/20 0.31
MEN1 O00255 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL704145 0.87 CA4 (0.37) ALDH1A1MAPK1TSHR
SCHEMBL27600931 0.84 CA4 (0.46) ALDH1A1KDM4ETDP1KMT2ALMNA
SCHEMBL7096596 0.82 ESR2 (0.46) ALDH1A1KDM4ETDP1KMT2ALMNA
SCHEMBL20594005 0.82
SCHEMBL7424773 0.82 MAOA (0.44) ALDH1A1TDP1MAPK1TSHRKMT2A
SCHEMBL17233741 0.82 SMN1; SMN2 (0.46) ALDH1A1KDM4ETDP1KMT2ALMNA
SCHEMBL754087 0.81 TRPA1 (0.41) ALDH1A1TSHR
SCHEMBL4470099 0.81 MAOB (0.42) ALDH1A1KDM4EMAPK1ABCG2KMT2A
SCHEMBL29910455 0.81 MAOB (0.42) ALDH1A1KDM4EMAPK1ABCG2KMT2A
SCHEMBL4626091 0.79 ALDH1A1 (0.35) ALDH1A1KDM4ETDP1MAPK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114835742-A Fluorescent probe for detecting fluorine ions and preparation method and application thereof 上海应用技术大学 2022-08-02 CN claimed
CN-114835742-A Fluorescent probe for detecting fluorine ions and preparation method and application thereof 上海应用技术大学 2022-08-02 CN disclosed
EP-0877607-B1 BIPHENYL COMPOUNDS AND USE THEREOF AS OESTROGENIC AGENTS AVENTIS PHARMA SA (FR) 2006-11-15 EP disclosed
US-6794415-B2 Biphenyl compounds and their use as oestrogenic agents AVENTIS PHARMA S.A. (FR) 2004-09-21 US disclosed
US-20040043993-A1 Biphenyl compounds and their use as oestrogenic agents AVENTIS PHARMA S.A. 2004-03-04 US disclosed
US-6563008-B2 Treatment of disorders linked to hypofolliculinemia and of certain estrogen-dependent pathologies such as prostatic adenomas or carcinomas, and of benign tumours of the breast AVENTIS PHARMA S.A. (FR) 2003-05-13 US disclosed
US-20020156324-A1 BIPHENYL COMPOUNDS AND THEIR USE AS OESTROGENIC AGENTS AVENTIS PHARMA S.A. 2002-10-24 US disclosed
US-6448294-B1 SUCH AS 1,5-DICHORO- OR 5-(4-(2-(DIMETHYLAMINO)ETHOXY)PHENYL) SUBSTITUTED -6-(4-HYDROXYPHENYL)-2-NAPHTHALENOLS; ANTIUTERO-TROPHIC AND REPLACEMENT TREATMENT OF SYMPTOMS LINKED TO MENOPAUSE PARTICULARLY OSTEOPOROSIS AVENTIS PHARMA S.A. (FR) 2002-09-10 US disclosed
US-20020068736-A1 Biphenyl compounds and their use as oestrogenic agents LESUISSE DOMINIQUE (FR) 2002-06-06 US disclosed
EP-0880496-B1 BIPHENYL COMPOUNDS AND USE THEREOF AS OESTROGENIC AGENTS AVENTIS PHARMA SA (FR) 2002-05-29 EP disclosed
US-6147119-A TREATING HYPOFOLLICULINIA DISORDERS; ANTICARCINOGENIC, ANTIMETASTASIS AND ANTITUMOR AGENTS; PREMENSTRUAL TENSION, MENOPAUSE, OSTEOPOROSIS HOECHST MARION ROUSSEL (FR) 2000-11-14 US disclosed
EP-0757982-B1 Biphenylic compounds, process for their preparations and intermediates for this process, their use as 5-alpha-reductase inhibitors and pharmaceutical compositions containing them HOECHST MARION ROUSSEL INC (FR) 2000-09-20 EP disclosed
US-5965763-A Biphenyl compounds HOECHST MARION ROUSSEL (FR) 1999-10-12 US disclosed
US-5630962-A 2-Fluoropyridines, their preparation and their use in liquid crystal mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-20 US disclosed
US-5629428-A 3-Chloropyridines, and their use in liquid-crystal mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-13 US disclosed
EP-0757982-A1 Biphenylic compounds, process for their preparations and intermediates for this process, their use as 5-alpha-reductase inhibitors and pharmaceutical compositions containing them ROUSSEL UCLAF (FR) 1997-02-12 EP disclosed
US-5445763-A Ferroelectricity; switching and/or display devices containing outer plates, electrodes, at least one polarizer and one alignment layer HOECHST AKTIENGESELLSCHAFT (DE) 1995-08-29 US disclosed
US-5232916-A Inhibitors of leukotriene synthesis MERCK FROSST CANADA, INC. (CA) 1993-08-03 US disclosed
US-5102881-A Leukotriene biosynthesis inhibitor MERCK FROSST CANADA, INC. (CA) 1992-04-07 US disclosed
EP-0349062-A1 Quinoline ether alkanoic acid MERCK FROSST CANADA INC. (CA) 1990-01-03 EP 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-20020068736-A1 Biphenyl compounds and their use as oestrogenic agents ESR2, ESR1, CYP19A1 ALDH1A1 381/4885KDM4E 342/4885TDP1 4524/4885
US-20020156324-A1 BIPHENYL COMPOUNDS AND THEIR USE AS OESTROGENIC AGENTS SHBG, ESR2, CYP19A1 ALDH1A1 176/4885KDM4E 2009/4885TDP1 3294/4885
US-20040043993-A1 Biphenyl compounds and their use as oestrogenic agents CYP19A1, HSD17B11, GPER1 ALDH1A1 272/4885KDM4E 1103/4885TDP1 3945/4885

“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.