SCHEMBL25599557

SCHEMBL25599557

C=C1CC(C)CC(CC[C@H](NC(=O)c2ccc3ccccc3c2OCc2nc(C(F)(F)F)cs2)C(=O)O)C1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 3/20 0.37
PIN1 Q13526 2/20 0.32
MAPK11 Q15759 1/20 0.31
CASP1 P29466 1/20 0.31
CASP3 P42574 1/20 0.31
CASP7 P55210 1/20 0.31
CASP6 P55212 1/20 0.31
CASP8 Q14790 1/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 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
SCHEMBL25599374 0.87 CXCR2 (0.51) CXCR2
SCHEMBL25599284 0.87 CXCR2 (0.51) CXCR2
SCHEMBL25599361 0.85 NPC1 (0.37) MEN1NPC1RAB9AKMT2A
SCHEMBL25599341 0.84 CXCR2 (0.40) CXCR2CASP1CASP3CASP7CASP6
SCHEMBL25599046 0.84 CXCR2 (0.41) CXCR2
SCHEMBL25599246 0.84 CXCR2 (0.45) CXCR2CASP1CASP3CASP7CASP6
SCHEMBL25599010 0.83 CXCR2 (0.41) CXCR2CASP1CASP3CASP7CASP6
SCHEMBL25599566 0.82 CFTR (0.35) CXCR2CASP1CASP3CASP7CASP6
SCHEMBL25599278 0.82 CXCR2 (0.39) CXCR2CASP1CASP3CASP7CASP6
SCHEMBL25599321 0.82 CXCR2 (0.38) CXCR2CASP1CASP3CASP7CASP6

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-20230159439-A1 ARYLAMIDES AND METHODS OF USE THEREOF GENZYME CORPORATION 2023-05-25 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-20230159439-A1 ARYLAMIDES AND METHODS OF USE THEREOF CFTR, AADAC, ARSA CXCR2 1205/4885PIN1 1245/4885MAPK11 4034/4885

“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.