SCHEMBL25868512

SCHEMBL25868512

CC[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1c1ccc(Br)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 10/20 0.37
FPR2 P25090 10/20 0.37
GAA P10253 1/20 0.34
BCL2 P10415 1/20 0.34
BECN1 Q14457 1/20 0.34
SCN9A Q15858 1/20 0.34
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 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
SCHEMBL21341218 0.87 FPR1 (0.37) FPR1FPR2GAASCN9ANFKB1
SCHEMBL30832910 0.87 FPR1 (0.41) FPR1FPR2GAASCN9ANFKB1
SCHEMBL21341184 0.87 FPR1 (0.41) FPR1FPR2GAASCN9ANFKB1
SCHEMBL25868513 0.80 FPR2 (0.58) FPR1FPR2
SCHEMBL21314742 0.78 FPR1 (0.38) FPR1FPR2
SCHEMBL21332640 0.78 FPR1 (0.38) FPR1FPR2
SCHEMBL21340823 0.77 FPR2 (0.43) FPR1FPR2
SCHEMBL21341183 0.77 FPR2 (0.43) FPR1FPR2
SCHEMBL30832911 0.77 FPR2 (0.43) FPR1FPR2
SCHEMBL22820700 0.76 FPR2 (0.41) FPR1FPR2

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-11708327-B2 Phenylpyrrolidinone formyl peptide 2 receptor agonists BRISTOL-MYERS SQUIBB COMPANY (US) 2023-07-25 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-11708327-B2 Phenylpyrrolidinone formyl peptide 2 receptor agonists FPR1, FPR2, FPR3 FPR1 1/4885FPR2 2/4885GAA 4233/4885

“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.