SCHEMBL14149286

SCHEMBL14149286

Bc1ccc(CC(=O)CBr)cc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CPA1 P15085 1/20 0.38
CA2 P00918 2/20 0.35
CAMK2A Q9UQM7 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CES2 O00748 2/20 0.33
CES1 P23141 2/20 0.33
ABCC4 O15439 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
PTGS1 P23219 1/20 0.33
HTT P42858 1/20 0.33
AKR1B1 P15121 1/20 0.33
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
ANPEP P15144 1/20 0.32
ENPEP Q07075 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
SCHEMBL13432984 0.81 MEN1 (0.44) L3MBTL1LMNAGAAHTT
SCHEMBL5042101 0.80 GSK3B (0.50) L3MBTL1LMNAGAAHTT
SCHEMBL6238483 0.80 CA2 (0.58) CA2CAMK2ALMNAGAAFNTA
SCHEMBL559059 0.78 TPMT (0.38) CA2CAMK2A
SCHEMBL622333 0.78 GSK3B (0.52) TDP1L3MBTL1LMNAHTT
SCHEMBL12831753 0.78 L3MBTL1 (0.55) TDP1L3MBTL1LMNAGAA
SCHEMBL756910 0.78 PTPN1 (0.52) TDP1LMNAGAAHTT
SCHEMBL1892394 0.77 CES1 (0.58) CPA1TDP1L3MBTL1CES2CES1
SCHEMBL4954745 0.77 ALDH1A1 (0.52) CA2TDP1L3MBTL1CES2CES1
SCHEMBL12831751 0.75 LMNA (0.64) ABCC4LMNAGAATSHRPTGS1

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
EP-1660465-B1 PROCESS FOR THE SYNTHESIS OF BIARYL OXAZOLIDINONES MELINTA THERAPEUTICS INC (US) 2014-12-17 EP disclosed
US-8324398-B2 Process for the synthesis of biaryl oxazolidinones RIB-X PHARMACEUTICALS, INC. (US) 2012-12-04 US disclosed