SCHEMBL23129556

SCHEMBL23129556

O=C(CNc1ccc(Br)cc1)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 8/20 0.67
MMP2 P08253 2/20 0.50
MMP1 P03956 1/20 0.50
MMP3 P08254 1/20 0.50
MMP7 P09237 1/20 0.50
MMP9 P14780 1/20 0.50
MMP13 P45452 1/20 0.50
ACE P12821 4/20 0.49
MEN1 O00255 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 1/20 0.49
MME P08473 1/20 0.49

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
SCHEMBL7365767 0.90 MME (0.55) FPR2ACEMME
SCHEMBL18439036 0.85 FPR2 (0.77) FPR2MEN1NPC1RAB9AKMT2A
SCHEMBL18439034 0.85 FPR2 (0.77) FPR2MEN1NPC1RAB9AKMT2A
SCHEMBL6380805 0.81 FPR2 (1.00) FPR2
SCHEMBL6376031 0.81 FPR2 (1.00) FPR2
SCHEMBL6376040 0.81 FPR2 (1.00) FPR2
SCHEMBL19895755 0.78 FPR2 (0.60) FPR2MMP2MMP1MMP3MMP7
SCHEMBL18236105 0.78 FPR2 (0.60) FPR2MMP2MMP1MMP3MMP7
SCHEMBL21777173 0.78 MME (0.61) FPR2ACEMME
SCHEMBL11065217 0.77 ACE (0.60) FPR2MMP2MMP1MMP3MMP7

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
EP-3795148-A1 USE OF AGONISTS OF FORMYL PEPTIDE RECEPTOR 2 FOR TREATING OCULAR INFLAMMATORY DISEASES ALLERGAN, INC. (US) 2021-03-24 EP disclosed