SCHEMBL27354367

SCHEMBL27354367

Cc1cccc(BOC(C)(C)C(C)(C)O)c1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 4/20 0.37
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ LMNA P02545 1/20 0.33
▸ MEN1 O00255 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ PARP1 P09874 1/20 0.31
▸ HTR3E A5X5Y0 1/20 0.30
▸ HTR3B O95264 1/20 0.30
▸ HTR3A P46098 1/20 0.30
▸ HTR3D Q70Z44 1/20 0.30
▸ HTR3C Q8WXA8 1/20 0.30
▸ IDO1 P14902 1/20 0.30

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
SCHEMBL20962289 0.89 — —
SCHEMBL18540384 0.83 — —
SCHEMBL12687290 0.82 ALDH1A1 (0.30) ALDH1A1
SCHEMBL12831961 0.81 CYP3A4 (0.35) ALDH1A1MAPK1
SCHEMBL21125143 0.81 HDAC8 (0.39) ACHEALDH1A1MEN1HPGDKMT2A
SCHEMBL18540386 0.81 NPC1 (0.32) ALDH1A1LMNAMEN1KMT2A
SCHEMBL15896261 0.80 CYP2A6 (0.42) ALDH1A1MEN1KMT2A
SCHEMBL19120255 0.80 MGLL (0.33) MEN1KMT2A
SCHEMBL20366981 0.80 ALDH1A1 (0.34) ALDH1A1MAPK1
SCHEMBL21107549 0.79 KMO (0.35) MEN1KMT2A

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-2024010280-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2024-01-11 — — WO disclosed
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