Sugi Predict

Sugi Predict / Compounds / SCHEMBL8993701

SCHEMBL8993701

SCHEMBL8993701

CC(C)(C)OC(=O)N(c1cccn(C(Cc2ccc(C(=N)N)cc2)C(=O)N2CCCCC2)c1=O)S(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 7/20 0.45
▸ F2 P00734 5/20 0.45
▸ PRSS1 P07477 4/20 0.45
▸ PLG P00747 3/20 0.44
▸ PLAU P00749 3/20 0.44
▸ HPN P05981 2/20 0.39
▸ PRSS2 P07478 1/20 0.39
▸ PRSS3 P35030 1/20 0.39
▸ F12 P00748 1/20 0.39
▸ KLKB1 P03952 1/20 0.39
▸ PROC P04070 1/20 0.39

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
SCHEMBL8993767 0.69 F2 (0.62) F10F2PRSS1PLGPLAU
SCHEMBL7439785 0.69 PLG (0.83) F10PLGPLAUF12KLKB1
SCHEMBL8993691 0.69 F2 (0.64) F10F2PRSS1PLGPLAU
SCHEMBL8993715 0.68 F10 (0.40) F10F2
SCHEMBL4968238 0.68 PLG (0.62) F10F2PRSS1PLGPLAU
SCHEMBL8993773 0.67 SLC16A3 (0.48) F10F2PRSS1PLGPLAU
SCHEMBL8993742 0.67 PLG (0.49) F10F2PRSS1PLGPLAU
SCHEMBL872422 0.66 PLG (0.67) F10F2PRSS1PLGPLAU
SCHEMBL8144360 0.66 PLG (0.67) F10F2PRSS1PLGPLAU
SCHEMBL29651383 0.66 PLG (0.67) F10F2PRSS1PLGPLAU

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-5489583-A FOR TREATING OR PREVENTING THROMBOSIS BASF AKTIENGESELLSCHAFT (DE) 1996-02-06 — — US disclosed