SCHEMBL28348581

SCHEMBL28348581

CC(C)(C)OC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)Nc1ccc(Br)cc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 12/20 0.60
CTSS P25774 4/20 0.52
CTSK P43235 3/20 0.52
CTSB P07858 2/20 0.49
CTSL P07711 1/20 0.49
TACR2 P21452 2/20 0.49
AKT1 P31749 1/20 0.48
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL14889686 1.00 FPR2 (0.60) FPR2CTSSCTSKCTSBCTSL
SCHEMBL14902575 0.91 FPR2 (0.63) FPR2CTSSCTSKCTSBCTSL
SCHEMBL28352113 0.91 FPR2 (0.63) FPR2CTSSCTSKCTSBCTSL
SCHEMBL22175320 0.85 CTSS (0.46) FPR2CTSSCTSKCTSBCTSL
SCHEMBL14889868 0.85 FPR2 (0.70) FPR2TACR2MEN1NPC1RAB9A
SCHEMBL20484373 0.85 FPR2 (0.70) FPR2TACR2MEN1NPC1RAB9A
SCHEMBL14902624 0.83 FPR2 (0.70) FPR2MEN1NPC1RAB9AKMT2A
SCHEMBL28348563 0.83 FPR2 (0.70) FPR2MEN1NPC1RAB9AKMT2A
SCHEMBL22150325 0.83 FPR2 (0.70) FPR2MEN1NPC1RAB9AKMT2A
SCHEMBL14889720 0.82 FPR2 (0.71) FPR2TACR2MEN1NPC1RAB9A

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
CN-106518742-B Amide derivatives of N-urea substituted amino acids as formyl peptide receptor-like-1 (FPRL-1) receptor modulators 阿勒根公司 2020-01-21 CN claimed
CN-106518742-B Amide derivatives of N-urea substituted amino acids as formyl peptide receptor-like-1 (FPRL-1) receptor modulators 阿勒根公司 2020-01-21 CN disclosed