SCHEMBL517286

SCHEMBL517286

COC(=O)CCc1ccc(C#C[Si](C)(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.47
ADRB1 P08588 1/20 0.47
FFAR1 O14842 14/20 0.45
FFAR4 Q5NUL3 2/20 0.44
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43

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
SCHEMBL15956326 0.89 HPGD (0.45) FFAR1FFAR4
SCHEMBL3152947 0.84 CYP4F2 (0.51) FFAR1
SCHEMBL18642578 0.83 FFAR1 (0.66) FFAR1FFAR4
SCHEMBL1551350 0.82 FFAR1 (0.68) ADRB2ADRB1FFAR1FFAR4CYP11B1
SCHEMBL1550669 0.81 FFAR1 (0.68) FFAR1FFAR4
SCHEMBL21778356 0.81 ADRB2 (0.49) ADRB2ADRB1FFAR1FFAR4
SCHEMBL1550285 0.81 FFAR1 (0.69) ADRB2ADRB1FFAR1FFAR4
SCHEMBL15820059 0.80 FFAR1 (0.48) ADRB2ADRB1FFAR1FFAR4CYP11B1
SCHEMBL3686971 0.80 ADRB2 (0.48) ADRB2ADRB1FFAR1FFAR4
SCHEMBL22922181 0.80 CYP4F2 (0.59) ADRB2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108026018-B Diphenylacetylene compound 国立大学法人大阪大学 2021-01-15 CN disclosed
US-10577396-B2 Tolan compound OSAKA UNIVERSITY (JP) 2020-03-03 US disclosed
US-10577396-B2 Tolan compound OSAKA UNIVERSITY (JP) 2020-03-03 US disclosed
US-20180258141-A1 TOLAN COMPOUND OSAKA UNIVERSITY (JP) 2018-09-13 US disclosed
US-9789118-B2 Bicyclic acetyl-CoA carboxylase inhibitors and uses thereof NOVARTIS AG (CH) 2017-10-17 US disclosed
US-9789118-B2 Bicyclic acetyl-CoA carboxylase inhibitors and uses thereof NOVARTIS AG (CH) 2017-10-17 US disclosed
US-9789118-B2 Bicyclic acetyl-CoA carboxylase inhibitors and uses thereof NOVARTIS AG (CH) 2017-10-17 US disclosed
EP-2598486-B1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS NOVARTIS AG (CH) 2017-06-28 EP disclosed
EP-2598486-B1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS NOVARTIS AG (CH) 2017-06-28 EP disclosed
WO-2017047807-A1 TOLAN COMPOUND 国立大学法人大阪大学 2017-03-23 WO disclosed
US-8586607-B2 Compounds for the treatment of metabolic diseases SYDDANSK UNIVERSITET (DK) 2013-11-19 US disclosed
EP-2598486-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS Novartis AG (CH) 2013-06-05 EP disclosed
EP-2313360-B1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES UNIV SYDDANSK (DK) 2012-09-05 EP disclosed
US-20120028969-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2012-02-02 US disclosed
US-20120028969-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2012-02-02 US disclosed
WO-2012013716-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS NOVARTIS AG (CH) 2012-02-02 WO disclosed
US-20110152315-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES SYDDANSK UNIVERSITET 2011-06-23 US disclosed
US-20110152315-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES SYDDANSK UNIVERSITET 2011-06-23 US disclosed
EP-2313360-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES Syddansk Universitet (DK) 2011-04-27 EP disclosed
WO-2010012650-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES SYDDANSK UNIVERSITET (DK) 2010-02-04 WO 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 (4 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-10577396-B2 Tolan compound TAP1, GRN, TSG101 ADRB2 3106/4885ADRB1 2160/4885FFAR1 3436/4885
US-20110152315-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES GPR119, INSR, GPR65 ADRB2 214/4885ADRB1 54/4885FFAR1 6/4885
US-20180258141-A1 TOLAN COMPOUND TAP1, GRN, TSG101 ADRB2 3106/4885ADRB1 2160/4885FFAR1 3436/4885
US-20120028969-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF ACACA, ACACB, COASY ADRB2 3043/4885ADRB1 1874/4885FFAR1 1817/4885

“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.