SCHEMBL9683629

SCHEMBL9683629

C/C=C/Cc1nc(Cl)c(C=O)n1Cc1ccc(-c2ccccc2C(=O)OC)cc1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46
GP6 Q9HCN6 1/20 0.45
AGTR1 P30556 2/20 0.43
AGTR2 P50052 2/20 0.43

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
SCHEMBL418 1.00 SLC6A4 (0.46) SLC6A4SLC6A3GP6AGTR1AGTR2
SCHEMBL137 0.90 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL9682924 0.90 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL409 0.88 AGTR2 (0.57) AGTR1AGTR2
SCHEMBL359 0.85 GP6 (0.63) GP6AGTR1AGTR2
SCHEMBL9683640 0.83 GP6 (0.46) SLC6A4SLC6A3GP6AGTR1AGTR2
SCHEMBL10587698 0.82 AGTR1 (0.49) GP6AGTR1AGTR2
SCHEMBL419 0.81 SLC6A4 (0.46) SLC6A4SLC6A3GP6AGTR1AGTR2
SCHEMBL417 0.81 SLC6A4 (0.46) SLC6A4SLC6A3GP6AGTR1AGTR2
SCHEMBL9684086 0.80 SLC6A4 (0.46) SLC6A4SLC6A3GP6AGTR1AGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5128355-A Hypotensive E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-07-07 US disclosed