SCHEMBL4686377

SCHEMBL4686377

N=C(N)c1ccc(OCc2cccc([C]=O)c2)cc1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F2 P00734 9/20 0.76
PRSS1 P07477 3/20 0.63
PRSS2 P07478 3/20 0.63
PRSS3 P35030 3/20 0.63
TMPRSS6 Q8IU80 2/20 0.60
ST14 Q9Y5Y6 2/20 0.60
F10 P00742 1/20 0.59

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
SCHEMBL14543821 0.87 F2 (1.00) F2PRSS1PRSS2PRSS3TMPRSS6
Hydrochloric Acid SCHEMBL28553185 0.85 F2 (1.00) F2PRSS1PRSS2PRSS3TMPRSS6
SCHEMBL14599643 0.80 F2 (0.80) F2PRSS1PRSS2PRSS3TMPRSS6
SCHEMBL7450283 0.80 F2 (0.91) F2PRSS1PRSS2PRSS3TMPRSS6
SCHEMBL7448742 0.80 F2 (0.80) F2PRSS1PRSS2PRSS3TMPRSS6
SCHEMBL4686383 0.80 F2 (0.74) F2PRSS1PRSS2PRSS3TMPRSS6
SCHEMBL7447051 0.79 F2 (0.89) F2PRSS1PRSS2PRSS3TMPRSS6
SCHEMBL6629683 0.79 F2 (0.83) F2PRSS1PRSS2PRSS3TMPRSS6
SCHEMBL23566292 0.78 PRSS1 (1.00) F2PRSS1PRSS2PRSS3TMPRSS6
Acetic Acid SCHEMBL10926932 0.77 F2 (0.74) F2PRSS1PRSS2PRSS3TMPRSS6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1236712-B1 AMIDINOPHENYLPYRUVIC ACID DERIVATIVE AJINOMOTO KK (JP) 2008-08-06 EP claimed
US-6710056-B2 PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF HAVE AN EXCELLENT ANTAGONISTIC EFFECT AGAINST ACTIVATED BLOOD COAGULATION FACTOR VII. AJINOMOTO CO., INC. (JP) 2004-03-23 US claimed
US-20030109547-A1 Amidinophenylpyruvic acid derivatives AJINOMOTO CO. INC (JP) 2003-06-12 US claimed
EP-1236712-A1 AMIDINOPHENYLPYRUVIC ACID DERIVATIVE Ajinomoto Co., Inc. (JP) 2002-09-04 EP claimed
EP-1236712-B1 AMIDINOPHENYLPYRUVIC ACID DERIVATIVE AJINOMOTO KK (JP) 2008-08-06 EP disclosed
US-6710056-B2 PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF HAVE AN EXCELLENT ANTAGONISTIC EFFECT AGAINST ACTIVATED BLOOD COAGULATION FACTOR VII. AJINOMOTO CO., INC. (JP) 2004-03-23 US disclosed
US-20030109547-A1 Amidinophenylpyruvic acid derivatives AJINOMOTO CO. INC (JP) 2003-06-12 US disclosed
EP-1236712-A1 AMIDINOPHENYLPYRUVIC ACID DERIVATIVE Ajinomoto Co., Inc. (JP) 2002-09-04 EP 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 (1 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-20030109547-A1 Amidinophenylpyruvic acid derivatives HABP2, F2, F7 F2 2/4885PRSS1 81/4885PRSS2 145/4885

“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.