SCHEMBL29546193

SCHEMBL29546193

Cc1ccc(/C=C2\CCc3ccccc3C2=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MIF P14174 8/20 1.00
▸ MAOB P27338 2/20 0.77
▸ CYP19A1 P11511 3/20 0.68
▸ PKM P14618 2/20 0.68
▸ CYP11B2 P19099 1/20 0.68
▸ MAPK1 P28482 1/20 0.68
▸ MAPT P10636 7/20 0.67
▸ CASP3 P42574 4/20 0.67
▸ SENP8 Q96LD8 4/20 0.67
▸ SENP7 Q9BQF6 4/20 0.67
▸ SENP6 Q9GZR1 4/20 0.67
▸ RAB9A P51151 3/20 0.67
▸ NPC1 O15118 2/20 0.67
▸ KDM4E B2RXH2 1/20 0.67
▸ SMN1; SMN2 Q16637 3/20 0.66
▸ KMT2A Q03164 3/20 0.65
▸ MEN1 O00255 2/20 0.65
▸ ALDH1A1 P00352 2/20 0.65
▸ LMNA P02545 2/20 0.63
▸ HPGD P15428 1/20 0.63

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
SCHEMBL29013403 1.00 MIF (1.00) MIFMAOBCYP19A1PKMCYP11B2
SCHEMBL28040259 1.00 MIF (1.00) MIFMAOBCYP19A1PKMCYP11B2
SCHEMBL14033869 0.87 MAOB (0.81) MIFMAOBCYP19A1PKMCYP11B2
SCHEMBL980327 0.87 MAOB (1.00) MIFMAOBCYP19A1PKMCYP11B2
SCHEMBL820654 0.87 MAOB (1.00) MIFMAOBCYP19A1PKMCYP11B2
SCHEMBL29546087 0.87 MAOB (1.00) MIFMAOBCYP19A1PKMCYP11B2
SCHEMBL29679848 0.87 MAOB (1.00) MIFMAOBCYP19A1PKMCYP11B2
SCHEMBL29546151 0.87 MAOB (1.00) MIFMAOBCYP19A1PKMCYP11B2
SCHEMBL15153677 0.87 MAOB (1.00) MIFMAOBCYP19A1PKMCYP11B2
SCHEMBL8545337 0.85 MIF (0.74) MIFMAOBCYP19A1PKMCYP11B2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117776867-A Method for synthesizing chiral alcohol with ortho-chiral center 湖州学院 2024-03-29 — — CN disclosed
CN-114230457-B 2-benzylidene tetralone derivatives, and preparation method and application thereof 中山大学 2023-06-09 — — CN disclosed
CN-114230457-A 2-benzylidene tetralone derivatives and preparation method and application thereof 中山大学 2022-03-25 — — CN disclosed
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