SCHEMBL28348563

SCHEMBL28348563

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

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 17/20 0.70
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA9 Q16790 1/20 0.56
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
MAPT P10636 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52

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
SCHEMBL14902624 1.00 FPR2 (0.70) FPR2CA12CA1CA2CA9
SCHEMBL28352113 0.86 FPR2 (0.63) FPR2MEN1KMT2ANPC1RAB9A
SCHEMBL14902575 0.86 FPR2 (0.63) FPR2MEN1KMT2ANPC1RAB9A
SCHEMBL6315910 0.85 CYP3A4 (0.54) FPR2MEN1KMT2AMAPTNPSR1
SCHEMBL7342352 0.84 FPR2 (0.52) FPR2MAPTNPSR1
SCHEMBL7338444 0.84 FPR2 (0.52) FPR2MAPTNPSR1
SCHEMBL5421613 0.84 MAPT (0.60) FPR2CA12CA1CA2CA9
SCHEMBL20671518 0.84 CA12 (0.57) FPR2CA12CA1CA2CA9
SCHEMBL5421619 0.84 MAPT (0.60) FPR2CA12CA1CA2CA9
SCHEMBL14948969 0.84 TP53 (0.52) FPR2MEN1KMT2AMAPTNPSR1

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
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