SCHEMBL25340952

SCHEMBL25340952

CCOC(=O)c1ccc(C2CCOCC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.54
▸ CYP1A2 P05177 2/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ HPGD P15428 2/20 0.52
▸ TP53 P04637 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ CA12 O43570 1/20 0.51
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51
▸ ESR1 P03372 1/20 0.51
▸ CA7 P43166 1/20 0.51
▸ CA9 Q16790 1/20 0.51
▸ ESR2 Q92731 1/20 0.51
▸ CA14 Q9ULX7 1/20 0.51
▸ ALDH1A1 P00352 5/20 0.51
▸ SMN1; SMN2 Q16637 5/20 0.51
▸ LMNA P02545 2/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ MAOA P21397 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
SCHEMBL21757021 0.93 ALDH1A1 (0.48) RAB9ACYP1A2NPC1HPGDTP53
SCHEMBL4003420 0.89 CA12 (0.59) RAB9ACYP1A2NPC1HPGDCYP2C9
SCHEMBL12733223 0.85 ESR2 (0.42) RAB9ACYP1A2NPC1HPGDTP53
SCHEMBL1789154 0.84 ALDH1A1 (0.63) RAB9ACYP1A2NPC1CA12CA1
SCHEMBL28022173 0.83 FDFT1 (0.53) RAB9ACYP1A2NPC1HPGDTP53
SCHEMBL12733062 0.83 HPGD (0.53) RAB9ANPC1HPGDCYP2C19CA12
SCHEMBL1780878 0.82 CA12 (0.45) RAB9ACYP1A2NPC1HPGDTP53
SCHEMBL3289949 0.82 LMNA (0.54) RAB9ACYP1A2NPC1HPGDCYP2C9
SCHEMBL21656823 0.82 MAPT (0.53) RAB9ACYP1A2NPC1HPGDCA12
SCHEMBL433716 0.82 ESR2 (0.51) RAB9ACYP1A2NPC1HPGDTP53

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
US-12351924-B2 Electroreductive cross coupling OHIO STATE INNOVATION FOUNDATION (US) 2025-07-08 — — US disclosed
US-20230250539-A1 ELECTROREDUCTIVE CROSS COUPLING OHIO STATE INNOVATION FOUNDATION 2023-08-10 — — US disclosed
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