SCHEMBL13855386

SCHEMBL13855386

C=C(C)OC(=O)/N=C(\N)c1ccc(NC(=O)OCC(=O)N[C@@H](C)c2cccc(OC)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F7 P08709 3/20 0.52
▸ F2 P00734 2/20 0.52
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ ROCK2 O75116 9/20 0.42
▸ ROCK1 Q13464 8/20 0.42
▸ PRKG1 Q13976 4/20 0.42
▸ CYP3A4 P08684 3/20 0.42
▸ CYP2D6 P10635 2/20 0.42
▸ CYP2C9 P11712 2/20 0.42
▸ PRKACA P17612 2/20 0.42
▸ CHEK1 O14757 1/20 0.42
▸ RPS6KA5 O75582 1/20 0.42
▸ PRKCG P05129 1/20 0.42
▸ CDK1 P06493 1/20 0.42
▸ RPS6KB1 P23443 1/20 0.42
▸ CDK2 P24941 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ AKT2 P31751 1/20 0.42
▸ GSK3A P49840 1/20 0.42

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
SCHEMBL13855053 0.87 F7 (0.53) F7F2MEN1KMT2AROCK2
SCHEMBL13855062 0.83 F7 (0.73) F7F2MEN1KMT2AROCK2
SCHEMBL13855056 0.83 F7 (0.73) F7F2MEN1KMT2AROCK2
SCHEMBL13855066 0.77 F7 (0.61) F7F2MEN1KMT2AROCK2
SCHEMBL13855067 0.77 F7 (0.61) F7F2MEN1KMT2AROCK2
SCHEMBL13855387 0.77 ALDH1A1 (0.42) MEN1KMT2AMAPK1ALDH1A1MAPT
SCHEMBL13855060 0.70 F7 (0.67) F7F2
SCHEMBL13855061 0.70 F7 (0.67) F7F2
SCHEMBL2802124 0.69 F7 (1.00) F7F2
SCHEMBL231899 0.69 F7 (1.00) F7F2

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-20090130085-A1 Amidino-Compounds for Stabilizing Factor VII Polypeptide Formulations NOVO NORDISH HEALTHCARE AG (CH) 2009-05-21 — — US 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-20090130085-A1 Amidino-Compounds for Stabilizing Factor VII Polypeptide Formulations F7, F5, F8 F7 1/4885F2 9/4885MEN1 717/4885

“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.

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