SCHEMBL13062828

SCHEMBL13062828

CCNC(=O)COc1cccc(NC(=O)c2cc(-c3cccc(F)c3)ccc2F)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 1/20 0.52
SMN1; SMN2 Q16637 5/20 0.48
AHR P35869 1/20 0.48
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
LMNA P02545 2/20 0.44
MAPT P10636 1/20 0.44
F10 P00742 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
PIK3C3 Q8NEB9 1/20 0.43
LCLAT1 Q6UWP7 1/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL13757306 0.90 PTGER2 (0.53) PTGER2SMN1; SMN2AHRRAB9ANPC1
SCHEMBL13757307 0.89 PTGER2 (0.51) PTGER2SMN1; SMN2AHRRAB9ANPC1
SCHEMBL13063095 0.89 PTGER2 (0.58) PTGER2SMN1; SMN2AHRRAB9ANPC1
SCHEMBL13063094 0.89 PTGER2 (0.50) PTGER2SMN1; SMN2AHRRAB9ANPC1
SCHEMBL13017411 0.88 PTGER2 (0.52) PTGER2SMN1; SMN2RAB9ANPC1LMNA
SCHEMBL3660760 0.87 ALDH1A1 (0.55) PTGER2SMN1; SMN2AHRRAB9ANPC1
SCHEMBL29781355 0.87 PTGER2 (0.67) PTGER2SMN1; SMN2AHRRAB9ANPC1
SCHEMBL3062083 0.87 PTGER2 (0.67) PTGER2SMN1; SMN2AHRRAB9ANPC1
SCHEMBL29372302 0.87 PTGER2 (0.67) PTGER2SMN1; SMN2AHRRAB9ANPC1
SCHEMBL3050603 0.86 PTGER2 (0.52) PTGER2SMN1; SMN2AHRRAB9ANPC1

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-20100331410-A1 Biaryl Amides ASTERAND UK LIMITED (GB) 2010-12-30 US disclosed
WO-2009098458-A2 BIARYL AMIDES ASTERAND UK LIMITED (GB) 2009-08-13 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 (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-20100331410-A1 Biaryl Amides AGTR2, CYP11B2, ALDH1A2 PTGER2 242/4885SMN1; SMN2 4848/4885AHR 795/4885

“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.