SCHEMBL20906356

SCHEMBL20906356

Cc1cc(C(C)(C)C)c(OCCO)c(C)c1CP(c1ccccc1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SCN2A Q99250 2/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ RECQL P46063 1/20 0.33
▸ GAA P10253 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ RARA P10276 1/20 0.30
▸ RARB P10826 1/20 0.30
▸ RARG P13631 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
SCHEMBL20906680 0.84 ADRA2A (0.36) ALDH1A1
SCHEMBL20906756 0.80 KDM4E (0.30) ALDH1A1KDM4E
SCHEMBL20906378 0.78 CYP2C19 (0.43) ALDH1A1GAA
SCHEMBL20906379 0.74 CA2 (0.36) SCN2AALDH1A1GAA
SCHEMBL20906752 0.72 HTR2A (0.31) —
SCHEMBL20906368 0.72 — —
SCHEMBL20906373 0.71 — —
SCHEMBL20906372 0.71 ATP4A (0.34) ALDH1A1KDM4E
SCHEMBL20906376 0.70 LMNA (0.32) —
SCHEMBL20906691 0.70 LTA4H (0.35) —

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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