SCHEMBL10323313

SCHEMBL10323313

CC(C)(C)OC(=O)N(c1cccc(C(N)(Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)S(=O)(=O)c2cccnc2)n1)C(C(=O)O)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 11/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
F2 P00734 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
GRM2 Q14416 2/20 0.32
ADAMTS4 O75173 1/20 0.31

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
SCHEMBL534324 0.92 PTGER2 (0.38) PTGER2ADAMTS4
SCHEMBL533799 0.91 PTGER2 (0.34) PTGER2KMT2A
SCHEMBL10322180 0.90 PTGER2 (0.34) PTGER2
SCHEMBL533599 0.89 PTGER2 (0.42) PTGER2ALDH1A1ADAMTS4
SCHEMBL533712 0.89 PTGER2 (0.40) PTGER2GRM2ADAMTS4
SCHEMBL534169 0.89 PTGER2 (0.40) PTGER2ADAMTS4
SCHEMBL13571748 0.88 PTGER2 (0.42) PTGER2
SCHEMBL11021481 0.88 PTGER2 (0.41) PTGER2ADAMTS4
SCHEMBL533581 0.87 PTGER2 (0.33) PTGER2
SCHEMBL17472613 0.87 PTGER2 (0.47) PTGER2F2MAPTADAMTS4

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-20120184747-A1 ANILINE COMPOUND UBE INDUSTRIES, LTD. (JP) 2012-07-19 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-20120184747-A1 ANILINE COMPOUND PTGER2, ADRB2, PTGER1 PTGER2 1/4885NPC1 2992/4885RAB9A 3335/4885

“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.