SCHEMBL28967714

SCHEMBL28967714

c1cc2c3c(csc3c1)CC1CN(CC3CC3)CCN21

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 12/20 0.56
▸ HTR1A P08908 2/20 0.33
▸ OPRM1 P35372 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
SCHEMBL30179191 1.00 DRD2 (0.56) DRD2HTR1AOPRM1
SCHEMBL29324627 0.86 DRD2 (0.61) DRD2HTR1A
SCHEMBL29325061 0.86 DRD2 (0.46) DRD2HTR1A
SCHEMBL29324093 0.86 DRD2 (0.50) DRD2HTR1A
SCHEMBL29323098 0.84 DRD2 (0.62) DRD2
SCHEMBL30179173 0.84 DRD2 (0.48) DRD2HTR1A
SCHEMBL29322785 0.84 DRD2 (0.48) DRD2HTR1A
SCHEMBL29325040 0.83 DRD2 (0.44) DRD2HTR1A
SCHEMBL29322794 0.83 DRD2 (0.44) DRD2HTR1A
SCHEMBL29323645 0.82 DRD2 (0.58) DRD2HTR1AOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4400504-A1 THIOPHENE RING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Center for Excellence in Molecular Cell Science, Chinese Academy of Sciences (CN) 2024-07-17 — — EP disclosed
EP-4400504-A1 THIOPHENE RING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Center for Excellence in Molecular Cell Science, Chinese Academy of Sciences (CN) 2024-07-17 — — EP disclosed
CN-115772175-A Thieno-ring compounds, process for their preparation and their use 中国科学院分子细胞科学卓越创新中心 2023-03-10 — — CN disclosed
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