SCHEMBL6022934

SCHEMBL6022934

N=C(N)c1cc[c]c(O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F12 P00748 2/20 0.44
LMNA P02545 1/20 0.43
PRSS1 P07477 9/20 0.42
PRSS3 P35030 8/20 0.42
PRSS2 P07478 7/20 0.42
F2 P00734 4/20 0.41
C1S P09871 3/20 0.41
PLG P00747 2/20 0.41
PLAU P00749 2/20 0.41
KLKB1 P03952 1/20 0.41
KLK1 P06870 1/20 0.41
F10 P00742 1/20 0.39
F7 P08709 1/20 0.39
F3 P13726 1/20 0.39
PKM P14618 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.38
BLM P54132 1/20 0.38
MASP2 O00187 1/20 0.38
THPO P40225 1/20 0.38
RECQL P46063 1/20 0.37

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
SCHEMBL12971526 0.78 PARP1 (0.47) BLMRECQLKMT2A
SCHEMBL1950632 0.77 PRSS1 (0.50) F12LMNAPRSS1PRSS3PRSS2
SCHEMBL1949948 0.77 PRSS1 (0.41) F12LMNAPRSS1PRSS3PRSS2
SCHEMBL1950671 0.77 LMNA (0.43) F12LMNAPRSS1PRSS3PRSS2
SCHEMBL8170563 0.72 F10 (0.38) F12LMNAPRSS1PRSS3PRSS2
SCHEMBL7985427 0.72 PRSS1 (0.41) F12PRSS1PRSS3PRSS2F2
SCHEMBL7985574 0.72 PRSS1 (0.49) PRSS1PRSS3PRSS2C1SPLG
SCHEMBL8170922 0.72 PRSS1 (0.41) F12PRSS1PRSS3PRSS2F2
SCHEMBL4587392 0.72 PLAU (0.50) PRSS1F2PLGPLAUKLKB1
SCHEMBL6022788 0.72 PRSS1 (0.48) F12LMNAPRSS1PRSS3PRSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7105559-B2 Substituted 5-membered polycyclic compounds useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION (US) 2006-09-12 US disclosed
US-20050267123-A1 6-Membered heterocyclic compounds useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION (US) 2005-12-01 US disclosed
US-6969715-B2 6-membered heterocyclic compounds useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION (US) 2005-11-29 US disclosed
US-20050239860-A1 Substituted 5-membered polycyclic compounds useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION (US) 2005-10-27 US disclosed
EP-1438292-A1 6-MEMBERED HETEROCYCLIC COMPOUNDS USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE Pharmacia Corporation (US) 2004-07-21 EP disclosed
EP-1432687-A2 SUBSTITUTED 5-MEMBERED POLYCYCLIC COMPOUNDS USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE Pharmacia Corporation (US) 2004-06-30 EP disclosed
WO-2003093242-A2 SUBSTITUTED 5-MEMBERED POLYCYCLIC COMPOUNDS USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE PHARMACIA CORPORATION (US) 2003-11-13 WO disclosed
US-20030162776-A1 Substituted 5-membered polycyclic compounds useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2003-08-28 US disclosed
US-20030139405-A1 6-Membered heterocyclic compounds useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2003-07-24 US disclosed
WO-2003029216-A1 6-MEMBERED HETEROCYCLIC COMPOUNDS USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE PHARMACIA CORPORATION (US) 2003-04-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030162776-A1 Substituted 5-membered polycyclic compounds useful for selective inhibition of the coagulation cascade TFPI, F2, SERPINC1 F12 16/4885LMNA 872/4885PRSS1 39/4885
US-20050267123-A1 6-Membered heterocyclic compounds useful for selective inhibition of the coagulation cascade TFPI, F2, SERPINC1 F12 12/4885LMNA 1275/4885PRSS1 55/4885
US-20030139405-A1 6-Membered heterocyclic compounds useful for selective inhibition of the coagulation cascade TFPI, F2, SERPINC1 F12 12/4885LMNA 1275/4885PRSS1 55/4885
US-20050239860-A1 Substituted 5-membered polycyclic compounds useful for selective inhibition of the coagulation cascade TFPI, F2, SERPINC1 F12 16/4885LMNA 872/4885PRSS1 39/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.