SCHEMBL20906756

SCHEMBL20906756

COC(C)(C)c1cc(C)c(CP(c2ccccc2)c2ccccc2)c(C)c1OCCOCC(C)(COCCOc1c(C(C)(C)C)cc(C)c(CP(c2ccccc2)c2ccccc2)c1C)COCCOc1c(C(C)(C)C)cc(C)c(CP(c2ccccc2)c2ccccc2)c1C

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ SMN1; SMN2 Q16637 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
SCHEMBL20906376 0.83 LMNA (0.32) —
SCHEMBL20906356 0.80 SCN2A (0.33) KDM4EALDH1A1
SCHEMBL20906680 0.78 ADRA2A (0.36) ALDH1A1
SCHEMBL20906380 0.77 — —
SCHEMBL20906752 0.76 HTR2A (0.31) —
SCHEMBL20906373 0.71 — —
SCHEMBL20906378 0.69 CYP2C19 (0.43) ALDH1A1SMN1; SMN2
SCHEMBL20906379 0.67 CA2 (0.36) ALDH1A1SMN1; SMN2
SCHEMBL20906372 0.67 ATP4A (0.34) KDM4EALDH1A1SMN1; SMN2
SCHEMBL20906368 0.65 — —

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-2019071428-A1 COMPOUND, PHOTOPOLYMERIZATION INITIATOR, PHOTOCURABLE COMPOSITION AND CURED PRODUCT THEREOF, AND PHOTOCURABLE INK AND PRINT USING THE SAME DIC CORPORATION (JP) 2019-04-18 — — WO disclosed
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