SCHEMBL29668595

SCHEMBL29668595

CC(Br)OC(=O)CC1CC1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
BRD4 O60885 1/20 0.33
SLC1A3 P43003 2/20 0.32
SLC1A2 P43004 2/20 0.32
SLC1A1 P43005 2/20 0.32
ANPEP P15144 1/20 0.31
ENPEP Q07075 1/20 0.31
ACACB O00763 1/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP9 P14780 1/20 0.31
MMP13 P45452 1/20 0.31
CTSL P07711 2/20 0.30
CTSB P07858 2/20 0.30
CTSK P43235 2/20 0.30
LIPA P38571 1/20 0.30

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
SCHEMBL28556015 0.77 TDP1 (0.32) L3MBTL1TDP1CTSLCTSBCTSK
SCHEMBL29210828 0.76 SHBG (0.36) L3MBTL1TDP1BRD4
SCHEMBL29080682 0.76 LMNA (0.36) L3MBTL1TDP1
SCHEMBL7606622 0.76 TSHR (0.38) L3MBTL1TDP1BRD4SLC1A3SLC1A2
SCHEMBL19259372 0.75 L3MBTL1 (0.45) L3MBTL1TDP1SLC1A3SLC1A2SLC1A1
SCHEMBL30304705 0.75 LMNA (0.35) L3MBTL1TDP1SLC1A3SLC1A2SLC1A1
SCHEMBL28319298 0.75 LMNA (0.35) L3MBTL1TDP1SLC1A3SLC1A2SLC1A1
SCHEMBL7569020 0.73 L3MBTL1 (0.47) L3MBTL1TDP1SLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL29210818 0.73 LMNA (0.34) L3MBTL1TDP1SLC1A3SLC1A2SLC1A1
SCHEMBL2434202 0.73 L3MBTL1 (0.33) L3MBTL1TDP1

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
WO-2022111624-A1 BENZIMIDAZOLE DERIVATIVE AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 深圳信立泰药业股份有限公司 2022-06-02 WO disclosed