SCHEMBL27480614

SCHEMBL27480614

COC(C)C(c1ccc(C(F)(F)F)cc1)C(C)OC

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 4/20 0.44
▸ AKR1C3 P42330 2/20 0.39
▸ AKR1C2 P52895 2/20 0.39
▸ CES2 O00748 1/20 0.38
▸ CES1 P23141 1/20 0.38
▸ CASR P41180 3/20 0.38
▸ ACP3 P15309 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ MC4R P32245 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ TSHR P16473 1/20 0.34
▸ KIF11 P52732 1/20 0.34

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
SCHEMBL27478086 0.87 AKR1C3 (0.39) PDE2AAKR1C3AKR1C2CES2CES1
SCHEMBL12784515 0.79 PDE2A (0.47) PDE2AAKR1C3AKR1C2CES2CES1
SCHEMBL26299730 0.79 PDE2A (0.50) PDE2AAKR1C3AKR1C2CES2CES1
SCHEMBL11393154 0.77 PDE2A (0.44) PDE2AAKR1C3AKR1C2CES2CES1
SCHEMBL17789936 0.74 PDE2A (0.47) PDE2AAKR1C3AKR1C2CES2CES1
SCHEMBL11403389 0.73 PDE2A (0.42) PDE2AAKR1C3AKR1C2CES2CES1
SCHEMBL12199230 0.73 PDE2A (0.42) PDE2AAKR1C3AKR1C2CES2CES1
SCHEMBL27624781 0.73 AKR1C3 (0.43) PDE2AAKR1C3AKR1C2CES2CES1
SCHEMBL84043 0.73 PDE2A (0.53) PDE2AAKR1C3AKR1C2CES2CES1
SCHEMBL7438101 0.72 PDE2A (0.52) PDE2AAKR1C3AKR1C2CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024126619-A1 ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING A COMPOUND OF FORMULA (I) AND A COMPOUND OF FORMULA (II), AND DISPLAY DEVICE COMPRISING THE ORGANIC ELECTROLUMINESCENT DEVICE NOVALED GMBH (DE) 2024-06-20 — — WO disclosed
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