SCHEMBL7409357

SCHEMBL7409357

Cc1cc(Cc2c(-c3ccc(OCCN4CCCC4)cc3)sc3cc(OCc4ccccc4)ccc23)ccc1CNS(C)(=O)=O

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2 P00734 11/20 0.65
ENPP3 O14638 2/20 0.48
ENPP1 P22413 2/20 0.45
ESR1 P03372 5/20 0.44
ESR2 Q92731 3/20 0.44
STS P08842 2/20 0.44

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
Oxalic Acid SCHEMBL7413137 0.89 F2 (0.76) F2ESR1ESR2STS
SCHEMBL7413476 0.88 F2 (0.69) F2ESR1ESR2
SCHEMBL6597917 0.88 F2 (0.71) F2ESR1ESR2
SCHEMBL7415282 0.86 F2 (0.67) F2ESR1ESR2
SCHEMBL6173524 0.82 F2 (0.65) F2ESR1ESR2
SCHEMBL6597527 0.82 F2 (0.67) F2ESR1ESR2
SCHEMBL6171549 0.81 F2 (0.73) F2ESR1ESR2
SCHEMBL6173590 0.81 F2 (0.75) F2ESR1ESR2
SCHEMBL6172105 0.81 F2 (0.65) F2ESR1ESR2
SCHEMBL7445699 0.80 F2 (0.60) F2ESR1ESR2

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-6350774-B1 Antithrombotic agents ELI LILLY AND COMPANY 2002-02-26 US disclosed