SCHEMBL1551253

SCHEMBL1551253

O=C(O)CCc1ccc(C#Cc2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 20/20 1.00
FFAR4 Q5NUL3 4/20 1.00
CHRM2 P08172 1/20 0.71
S1PR1 P21453 1/20 0.71
FPR1 P21462 1/20 0.71
FPR3 P25089 1/20 0.71
GPR183 P32249 1/20 0.71
APLNR P35414 1/20 0.71
GPR65 Q8IYL9 1/20 0.71

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
SCHEMBL18642574 0.89 FFAR1 (1.00) FFAR1FFAR4CHRM2S1PR1FPR1
SCHEMBL18657089 0.87 FFAR1 (0.90) FFAR1FFAR4CHRM2S1PR1FPR1
SCHEMBL18165302 0.87 FFAR1 (0.77) FFAR1FFAR4CHRM2S1PR1FPR1
SCHEMBL1550358 0.85 FFAR1 (1.00) FFAR1FFAR4
SCHEMBL1550727 0.85 FFAR1 (1.00) FFAR1FFAR4CHRM2S1PR1FPR1
SCHEMBL12087474 0.85 FFAR1 (1.00) FFAR1FFAR4CHRM2S1PR1FPR1
SCHEMBL1550287 0.84 FFAR1 (1.00) FFAR1FFAR4
SCHEMBL1551158 0.84 FFAR1 (1.00) FFAR1FFAR4
SCHEMBL1550926 0.84 FFAR1 (1.00) FFAR1FFAR4CHRM2S1PR1FPR1
SCHEMBL1551560 0.84 FFAR1 (1.00) FFAR1FFAR4

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 15 patents. 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
WO-2017047807-A1 TOLAN COMPOUND 国立大学法人大阪大学 2017-03-23 WO 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
US-8586607-B2 Compounds for the treatment of metabolic diseases SYDDANSK UNIVERSITET (DK) 2013-11-19 US disclosed
EP-2313360-B1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES UNIV SYDDANSK (DK) 2012-09-05 EP disclosed
EP-2313360-B1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES UNIV SYDDANSK (DK) 2012-09-05 EP 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
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 (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-10577396-B2 Tolan compound TAP1, GRN, TSG101 FFAR1 3436/4885FFAR4 3969/4885CHRM2 4470/4885
US-20110152315-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES GPR119, INSR, GPR65 FFAR1 6/4885FFAR4 12/4885CHRM2 580/4885
US-20180258141-A1 TOLAN COMPOUND TAP1, GRN, TSG101 FFAR1 3436/4885FFAR4 3969/4885CHRM2 4470/4885

“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.