SCHEMBL1277281

SCHEMBL1277281

C/C(=C\c1ccccc1-c1ccc(O)c(O)c1)C(=O)NC(=N)N

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.43
F10 P00742 7/20 0.39
PRSS1 P07477 3/20 0.35
MCL1 Q07820 3/20 0.34
ALOX5 P09917 3/20 0.33
F2 P00734 2/20 0.33
ACMSD Q8TDX5 2/20 0.33
BACE1 P56817 1/20 0.32
PTGER1 P34995 1/20 0.32
PTGER3 P43115 1/20 0.32
PTGER2 P43116 1/20 0.32
MIF P14174 1/20 0.32
KDM4E B2RXH2 1/20 0.32
APOBEC3A P31941 1/20 0.32
GFER P55789 1/20 0.32
HDAC1 Q13547 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32

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
SCHEMBL1277774 0.92 F10 (0.37) APPF10PRSS1MCL1F2
SCHEMBL1277373 0.91 F10 (0.39) APPF10PRSS1F2ACMSD
SCHEMBL1277699 0.90 F10 (0.37) APPF10PRSS1
SCHEMBL1277387 0.89 FYN (0.39) APPBACE1KDM4E
SCHEMBL1277277 0.88 BACE1 (0.40) F10PRSS1BACE1
SCHEMBL1277389 0.87 BAZ2B (0.38) F10BACE1
SCHEMBL1277133 0.86 F10 (0.37) F10PRSS1F2BACE1
SCHEMBL1277355 0.86 SLC9A3 (0.39) APPF10PRSS1F2
SCHEMBL1277160 0.85 SMN1; SMN2 (0.41) F10PRSS1
SCHEMBL1277698 0.85 MAPT (0.36) F10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088737-A2 NOVEL ACYL GUANIDINE DERIVATIVES AJINOMOTO CO., INC (JP) 2012-04-12 US disclosed
US-20120088737-A2 NOVEL ACYL GUANIDINE DERIVATIVES AJINOMOTO CO., INC (JP) 2012-04-12 US disclosed
US-20120088737-A2 NOVEL ACYL GUANIDINE DERIVATIVES AJINOMOTO CO., INC (JP) 2012-04-12 US disclosed
US-20110082109-A1 NOVEL ACYL GUANIDINE DERIVATIVES AJINOMOTO CO., INC. (JP) 2011-04-07 US disclosed
US-20110082109-A1 NOVEL ACYL GUANIDINE DERIVATIVES AJINOMOTO CO., INC. (JP) 2011-04-07 US disclosed
US-20110082109-A1 NOVEL ACYL GUANIDINE DERIVATIVES AJINOMOTO CO., INC. (JP) 2011-04-07 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 (2 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-20110082109-A1 NOVEL ACYL GUANIDINE DERIVATIVES SLC9A3, NHERF1, SLC9A2 APP 4138/4885F10 4727/4885PRSS1 3628/4885
US-20120088737-A2 NOVEL ACYL GUANIDINE DERIVATIVES SLC9A3, NHERF1, SLC9A2 APP 4138/4885F10 4727/4885PRSS1 3628/4885

“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.