Sugi Predict

Sugi Predict / Compounds / SCHEMBL8909375

SCHEMBL8909375

SCHEMBL8909375

N=C(N)c1cccc(Cn2c(-c3ccccc3)c(-c3ccccc3)n(Cc3ccc4ccc(C(=N)N)cc4c3)c2=O)c1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 16/20 0.53
▸ F2 P00734 6/20 0.53
▸ PRSS1 P07477 4/20 0.53
▸ PLAU P00749 3/20 0.50
▸ PLG P00747 1/20 0.47
▸ F7 P08709 1/20 0.46
▸ PRSS2 P07478 1/20 0.45
▸ PRSS3 P35030 1/20 0.45

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
SCHEMBL7366139 0.95 F10 (0.53) F10F2PRSS1PLAUPLG
SCHEMBL7360668 0.93 F2 (0.54) F10F2PRSS1PLAUPLG
SCHEMBL8908041 0.91 F10 (0.53) F10F2PRSS1PRSS2PRSS3
SCHEMBL7364511 0.91 F10 (0.57) F10F2PRSS1PRSS2PRSS3
SCHEMBL8438856 0.83 F10 (0.49) F10F2PRSS1PRSS2PRSS3
SCHEMBL8443278 0.83 F10 (0.52) F10F2PRSS1PRSS2PRSS3
SCHEMBL7358748 0.82 WDR5 (0.50) F10F2PRSS1PLAUF7
SCHEMBL8440190 0.82 F10 (0.46) F10F2PRSS1PLG
SCHEMBL8909337 0.81 F10 (0.51) F10F2PRSS1PRSS2PRSS3
SCHEMBL8520787 0.81 F10 (0.47) F10F2PRSS1PLG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5612363-A FACTOR XA INHIBITORS BERLEX LABORATORIES, INC. (US) 1997-03-18 — — US claimed
US-5612363-A FACTOR XA INHIBITORS BERLEX LABORATORIES, INC. (US) 1997-03-18 — — US disclosed