SCHEMBL7318669

SCHEMBL7318669

NC(CC(Oc1ccc(Cl)cc1)c1ccccc1)OC(=O)C(=O)OC(N)CC(Oc1ccc(Cl)cc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.49
SLC6A9 P48067 1/20 0.48
PPARG P37231 14/20 0.45
PPARA Q07869 14/20 0.45
SCN4A P35499 2/20 0.44
HTR1A P08908 1/20 0.41

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
SCHEMBL7319558 0.87 SLC6A4 (0.53) SLC6A4
SCHEMBL7310728 0.86 SLC6A9 (0.49) SLC6A4SLC6A9PPARGPPARAHTR1A
SCHEMBL7409524 0.86 SLC6A4 (0.49) SLC6A4SLC6A9PPARGPPARAHTR1A
SCHEMBL7306077 0.83 SLC6A4 (0.59) SLC6A4SLC6A9
SCHEMBL5027210 0.82 SLC6A9 (0.47) SLC6A4SLC6A9PPARGPPARAHTR1A
SCHEMBL7317062 0.80 SLC6A4 (0.54) SLC6A4PPARGPPARA
SCHEMBL4936018 0.79 CYP1A2 (0.43) SLC6A4SLC6A9PPARGPPARASCN4A
SCHEMBL7310188 0.79 LMNA (0.47) SLC6A4
SCHEMBL7317723 0.76 PPARG (0.45) SLC6A4PPARGPPARA
SCHEMBL7311168 0.76 KMT2A (0.50) SLC6A4SLC6A9HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4626549-A Treatment of obesity with aryloxyphenylpropylamines ELI LILLY AND COMPANY (US) 1986-12-02 US disclosed
US-4314081-A ANTIDEPRESSANTS ELI LILLY AND COMPANY (US) 1982-02-02 US disclosed
US-4194009-A ANTIDEPRESSANT ELI LILLY AND COMPANY (US) 1980-03-18 US disclosed
US-4018895-A Aryloxyphenylpropylamines in treating depression ELI LILLY AND COMPANY (US) 1977-04-19 US disclosed