SCHEMBL28846469

SCHEMBL28846469

COc1ccc2c(ccc3oc4c5cccc(OC)c5ccc4c32)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 8/20 0.52
▸ CYP1A2 P05177 3/20 0.42
▸ CYP2A6 P11509 2/20 0.42
▸ HNF4A P41235 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ AHR P35869 1/20 0.41
▸ ABCG2 Q9UNQ0 1/20 0.41
▸ BCHE P06276 1/20 0.40
▸ ACHE P22303 1/20 0.40
▸ CYP1A1 P04798 2/20 0.39
▸ CYP1B1 Q16678 2/20 0.39
▸ AR P10275 1/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.39

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
SCHEMBL30091399 1.00 MAOA (0.52) MAOACYP1A2CYP2A6HNF4AMEN1
SCHEMBL20349949 0.82 MAOA (0.70) MAOACYP2A6MEN1KMT2AAHR
SCHEMBL28846468 0.80 MAOA (0.46) MAOACYP1A2CYP2A6HNF4AMEN1
SCHEMBL30091396 0.80 MAOA (0.46) MAOACYP1A2CYP2A6HNF4AMEN1
SCHEMBL30091393 0.77 CA12 (0.42) MAOAKDM4EALDH1A1LMNA
SCHEMBL31026601 0.76 CYP2A6 (0.56) MAOACYP1A2CYP2A6HNF4AABCG2
SCHEMBL20349952 0.76 MAOA (0.56) MAOACYP1A2CYP2A6HNF4AMEN1
SCHEMBL27820663 0.75 CYP1A2 (0.55) MAOACYP1A2CYP2A6MEN1KMT2A
SCHEMBL29869216 0.75 CYP1A2 (0.57) MAOACYP1A2CYP2A6MEN1KMT2A
SCHEMBL443271 0.75 CYP1A2 (0.57) MAOACYP1A2CYP2A6MEN1KMT2A

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-115087648-B Compound, thermoplastic resin, optical member, and optical lens 三菱化学株式会社 2024-07-02 — — CN disclosed
CN-115087648-A Compound, thermoplastic resin, optical member, and optical lens 三菱化学株式会社 2022-09-20 — — CN disclosed
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