SCHEMBL7738320

SCHEMBL7738320

C=C(C)c1csc(-c2cc(C(=N)N)sc2SC)n1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PLAU P00749 9/20 0.69
C1S P09871 15/20 0.61
PLG P00747 1/20 0.56
PLAT P00750 1/20 0.56
PRSS1 P07477 1/20 0.56

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
Hydrochloric Acid SCHEMBL7475045 0.99 PLAU (0.67) PLAUC1SPLGPLATPRSS1
SCHEMBL6921044 0.82 PLAU (1.00) PLAUC1SPLGPLATPRSS1
SCHEMBL7736128 0.79 PLAU (0.70) PLAUC1SPLGPLATPRSS1
Hydrochloric Acid SCHEMBL7472212 0.78 PLAU (0.69) PLAUC1SPLGPLATPRSS1
SCHEMBL6924659 0.76 C1S (1.00) PLAUC1SPLGPLATPRSS1
SCHEMBL7736658 0.75 C1S (0.83) PLAUC1SPLGPLATPRSS1
Hydrochloric Acid SCHEMBL6924883 0.75 C1S (0.98) PLAUC1SPLGPLATPRSS1
SCHEMBL7738335 0.75 C1S (0.81) PLAUC1SPLGPLATPRSS1
SCHEMBL6926657 0.75 C1S (1.00) PLAUC1SPLGPLATPRSS1
SCHEMBL7738328 0.75 C1S (0.98) PLAUC1SPLGPLATPRSS1

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-6403633-B2 USEFUL ANTIANGIOGENIC, ANTIARTHRITIC, ANTIINFLAMMATORY, ANTIRESTENOTIC, ANTIINVASIVE, ANTIMETASTIC, ANTIOSTEOPOROTIC, ANTIRETINOPATHIC, CONTRACEPTIVE AND TUMORISTATIC TREATMENT AGENTS 3-DIMENSIONAL PHARMACEUTICALS, INC. 2002-06-11 US claimed