SCHEMBL9257325

SCHEMBL9257325

CN1C2CCC1[C@@H](/C=C/Cl)[C@@H](c1ccc(Cl)cc1)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 7/20 1.00
SLC6A2 P23975 3/20 0.67
SLC6A4 P31645 3/20 0.67

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
SCHEMBL9257320 1.00 SLC6A3 (1.00) SLC6A3SLC6A2SLC6A4
SCHEMBL9260012 0.85 SLC6A3 (0.76) SLC6A3SLC6A2SLC6A4
SCHEMBL9257271 0.85 SLC6A3 (1.00) SLC6A3SLC6A2SLC6A4
SCHEMBL9257274 0.85 SLC6A3 (1.00) SLC6A3SLC6A2SLC6A4
SCHEMBL7355992 0.85 SLC6A3 (0.76) SLC6A3SLC6A2SLC6A4
SCHEMBL7355995 0.85 SLC6A3 (0.76) SLC6A3SLC6A2SLC6A4
SCHEMBL9260009 0.85 SLC6A3 (0.76) SLC6A3SLC6A2SLC6A4
SCHEMBL7457834 0.82 SLC6A3 (0.70) SLC6A3SLC6A2SLC6A4
SCHEMBL7457839 0.82 SLC6A3 (0.70) SLC6A3SLC6A2SLC6A4
SCHEMBL7457828 0.82 SLC6A3 (0.70) SLC6A3SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5391744-A Enhanced analgesic and vasoconstrictive properties MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 1995-02-21 US disclosed
US-5268480-A Containing an aromatic ester MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 1993-12-07 US disclosed