SCHEMBL28633685

SCHEMBL28633685

COc1cc2c(cc1OC)-c1cc(C)ccc1C2=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.62
▸ MAOA P21397 1/20 0.59
▸ MAOB P27338 1/20 0.59
▸ ACHE P22303 1/20 0.52
▸ LCK P06239 1/20 0.47
▸ ALKBH3 Q96Q83 1/20 0.46
▸ PTPRC P08575 1/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ KMT2A Q03164 4/20 0.44
▸ USP2 O75604 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ MAPT P10636 3/20 0.41
▸ POLB P06746 1/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KDM4E B2RXH2 1/20 0.41

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
SCHEMBL16932394 0.86 ELANE (0.55) ELANEMAOAMAOBACHELCK
SCHEMBL30961641 0.86 ELANE (0.55) ELANEMAOAMAOBACHELCK
SCHEMBL25646740 0.84 ACHE (0.47) ELANEMAOAMAOBACHEKMT2A
SCHEMBL22799422 0.83 ELANE (0.78) ELANEMAOAMAOBLCKALKBH3
SCHEMBL3899483 0.83 CA1 (0.54) ACHELCKPTPRCPTPN1KMT2A
SCHEMBL4401141 0.83 ELANE (0.77) ELANEMAOAMAOBACHELCK
SCHEMBL182959 0.83 ELANE (0.86) ELANEMAOAMAOBLCKALKBH3
SCHEMBL583153 0.83 ELANE (0.86) ELANEMAOAMAOBLCKALKBH3
SCHEMBL31369142 0.81 CA1 (0.56) ACHELCKPTPRCPTPN1KMT2A
SCHEMBL18048115 0.81 CA1 (0.56) ACHELCKPTPRCPTPN1KMT2A

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-113443950-B Method for reducing carbonyl into methylene under illumination 中山大学 2023-11-03 — — CN claimed
CN-113443950-B Method for reducing carbonyl into methylene under illumination 中山大学 2023-11-03 — — CN disclosed
CN-113443950-A Method for reducing carbonyl into methylene under illumination 中山大学 2021-09-28 — — CN disclosed
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