SCHEMBL29496958

SCHEMBL29496958

Cc1cccc(COc2ccc(CCO)cc2)c1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 6/20 0.62
▸ FFAR1 O14842 6/20 0.60
▸ CYP4F2 P78329 1/20 0.54
▸ CYP4A11 Q02928 1/20 0.54
▸ LTA4H P09960 1/20 0.54
▸ EPHX2 P34913 1/20 0.54
▸ MAOA P21397 1/20 0.51
▸ ENPP2 Q13822 1/20 0.50

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
SCHEMBL962614 1.00 MAOB (0.62) MAOBFFAR1CYP4F2CYP4A11LTA4H
SCHEMBL14437517 0.87 MAOB (0.66) MAOBFFAR1MAOA
SCHEMBL30398600 0.87 MAOB (0.66) MAOBFFAR1MAOA
SCHEMBL10866245 0.83 MAOB (0.69) MAOBFFAR1MAOA
SCHEMBL257781 0.83 MAOB (0.69) MAOBFFAR1MAOA
SCHEMBL12570735 0.82 FFAR1 (0.85) FFAR1
SCHEMBL17935643 0.82 MAOB (0.56) MAOBFFAR1MAOA
SCHEMBL9125234 0.82 MAOB (0.60) MAOBFFAR1CYP4F2CYP4A11LTA4H
SCHEMBL9628508 0.81 MAOB (0.71) MAOBCYP4F2CYP4A11LTA4HEPHX2
SCHEMBL4425903 0.81 MAOB (0.73) MAOBCYP4F2CYP4A11LTA4HEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113646052-B Reversible thermochromic composition, reversible thermochromic microcapsule pigment, and writing instrument 百乐墨水株式会社 2024-05-17 — — CN disclosed
CN-110446770-B Reversible thermochromic composition and reversible thermochromic microcapsule pigment containing the same 百乐墨水株式会社 2023-08-08 — — CN disclosed
CN-113785023-B Water-based ink composition for reversible thermochromic writing instrument, refill for refill and water-based ballpoint pen incorporating same 株式会社百乐 2023-05-12 — — CN disclosed
CN-111263795-B Reversible thermal discoloration aqueous ink composition and writing instrument using the same 株式会社百乐 2022-05-03 — — CN disclosed
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