SCHEMBL28039186

SCHEMBL28039186

CC(=O)Cc1cccc2c[c]cnc12

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ MTNR1A P48039 3/20 0.34
▸ MTNR1B P49286 3/20 0.34
▸ HDAC6 Q9UBN7 2/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ SLC22A12 Q96S37 1/20 0.32
▸ PTGDR2 Q9Y5Y4 1/20 0.32
▸ ADORA2A P29274 1/20 0.32
▸ ADORA1 P30542 1/20 0.32
▸ PARP1 P09874 1/20 0.31
▸ IAPP P10997 1/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31

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
SCHEMBL5749692 0.82 GABRA1 (0.36) L3MBTL1ALDH1A1LMNATDP1PARP1
SCHEMBL19036261 0.79 HDAC6 (0.50) HDAC6ALDH1A1LMNATDP1SLC22A12
SCHEMBL28039089 0.76 CYP1A2 (0.40) L3MBTL1MTNR1AMTNR1BALDH1A1LMNA
SCHEMBL28039081 0.73 L3MBTL1 (0.37) L3MBTL1MTNR1AMTNR1BALDH1A1LMNA
SCHEMBL5747397 0.72 KCNH2 (0.44) —
SCHEMBL28140575 0.71 ALDH1A1 (0.46) L3MBTL1ALDH1A1LMNATDP1PARP1
SCHEMBL5749246 0.70 PARP1 (0.60) ALDH1A1PARP1
SCHEMBL16289274 0.70 METAP2 (0.53) ALDH1A1LMNAKMT2A
SCHEMBL5749261 0.70 ALDH1A1 (0.35) L3MBTL1ALDH1A1LMNATDP1PARP1
SCHEMBL28039041 0.68 TDP1 (0.43) L3MBTL1MTNR1ALMNATDP1MEN1

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-104955332-B The method of preventing and treating arthropod insect 住友化学株式会社 2017-03-29 — — CN disclosed
CN-104955332-A Method for controlling arthropod pest SUMITOMO CHEMICAL CO 2015-09-30 — — CN disclosed
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