SCHEMBL10653698

SCHEMBL10653698

O=C(O)C1CCc2ccsc21

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 7/20 0.37
HTR1A P08908 1/20 0.34
DRD2 P14416 1/20 0.34
HTR7 P34969 1/20 0.34
GRIN2B Q13224 1/20 0.33
AKR1C3 P42330 1/20 0.33
ACE P12821 1/20 0.33

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
SCHEMBL10743323 0.72 LMNA (0.42) GRIN2B
SCHEMBL30101003 0.70 TAAR1 (0.51) TAAR1HTR1ADRD2HTR7
SCHEMBL4894264 0.70 TSHR (0.51) TAAR1
SCHEMBL13344500 0.69 TAAR1 (0.39) TAAR1HTR1ADRD2HTR7
SCHEMBL21962476 0.69 DRD2 (0.43) DRD2GRIN2BAKR1C3ACE
SCHEMBL15083644 0.68 SMN1; SMN2 (0.33) TAAR1HTR1ADRD2HTR7
SCHEMBL13770917 0.68
SCHEMBL10745249 0.68 SIRT1 (0.34)
SCHEMBL7609208 0.66 KMT2A (0.43) TAAR1HTR1ADRD2HTR7
SCHEMBL28681399 0.66 HHAT (0.46) DRD2ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4649153-A ANTIINFLAMMATORY, ANALGESICS LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1987-03-10 US claimed
EP-0172041-B1 5,6-DIHYDRO-4H-CYCLOPENTA(B)THIOPHENE-6-CARBOXYLIC ACIDS, PROCESSES FOR THEIR PREPARATION AND THERAPEUTICAL AGENTS CONTAINING THEM LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1988-08-10 EP disclosed
US-4649153-A ANTIINFLAMMATORY, ANALGESICS LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1987-03-10 US disclosed
US-4649153-A ANTIINFLAMMATORY, ANALGESICS LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1987-03-10 US disclosed
EP-0172041-A1 5,6-Dihydro-4H-cyclopenta(b)thiophene-6-carboxylic acids, processes for their preparation and therapeutical agents containing them LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1986-02-19 EP disclosed