SCHEMBL6698974

SCHEMBL6698974

CC(C)(C)[Si](Oc1ccc(B(O)O)cc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.49
CA1 P00915 4/20 0.49
ENPP2 Q13822 4/20 0.43
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
MGLL Q99685 2/20 0.40
LPL P06858 2/20 0.34
LIPG Q9Y5X9 2/20 0.34
TUBB4A P04350 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31
TUBA1B P68363 1/20 0.31
TUBA4A P68366 1/20 0.31
TUBB4B P68371 1/20 0.31
TUBB3 Q13509 1/20 0.31
TUBB2A Q13885 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 0.82 CA4 (0.37) CA4
SCHEMBL7096596 0.81 ESR2 (0.46) CA2CA1CA4CA14
SCHEMBL8113015 0.81 CA1 (0.34) CA2CA1
SCHEMBL27600931 0.80 CA4 (0.46) CA2CA1CA4CA7CA14
SCHEMBL17233741 0.78 SMN1; SMN2 (0.46)
SCHEMBL20594005 0.78
SCHEMBL7424773 0.78 MAOA (0.44)
SCHEMBL6058734 0.78 ALDH1A1 (0.37)
SCHEMBL12919164 0.77 CA1 (0.46) CA2CA1
SCHEMBL3540870 0.77 LTA4H (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-6365775-B1 ANTIUTEROTROPHIC; TREATMENTS OF SYMPTOMS RELATED TO MENOPAUSE AND PREMENSTRAL SYNDRONE AVENTIS PHARMA S.A. (FR) 2002-04-02 US disclosed
US-6288126-B1 Biphenyl compounds and use thereof as oestrogenic agents AVENTIS PHARMA S.A. 2001-09-11 US 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
US-5629428-A 3-Chloropyridines, and their use in liquid-crystal mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-13 US disclosed
US-5562859-A SWITCHING AND DISPLAY DEVICE HOECHST AKTIENGESELLSCHAFT (DE) 1996-10-08 US 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

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 CA2 4562/4885CA1 3614/4885ENPP2 1608/4885
US-20020156324-A1 BIPHENYL COMPOUNDS AND THEIR USE AS OESTROGENIC AGENTS SHBG, ESR2, CYP19A1 CA2 1580/4885CA1 877/4885ENPP2 887/4885
US-20040043993-A1 Biphenyl compounds and their use as oestrogenic agents CYP19A1, HSD17B11, GPER1 CA2 1881/4885CA1 1198/4885ENPP2 979/4885

“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.