SCHEMBL20906761

SCHEMBL20906761

COc1c(C)cc(C)c(CP(c2ccccc2)c2ccccc2)c1OC

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ KCNB1 Q14721 1/20 0.30
▸ TUBB4A P04350 1/20 0.30
▸ TUBB P07437 1/20 0.30
▸ TUBA3C P0DPH7 1/20 0.30
▸ TUBA1B P68363 1/20 0.30
▸ TUBA4A P68366 1/20 0.30
▸ TUBB4B P68371 1/20 0.30
▸ TUBB3 Q13509 1/20 0.30
▸ TUBB2A Q13885 1/20 0.30
▸ TUBB8 Q3ZCM7 1/20 0.30
▸ TUBA3E Q6PEY2 1/20 0.30
▸ TUBA1A Q71U36 1/20 0.30
▸ TUBA1C Q9BQE3 1/20 0.30
▸ TUBB6 Q9BUF5 1/20 0.30
▸ TUBB2B Q9BVA1 1/20 0.30
▸ TUBB1 Q9H4B7 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
SCHEMBL20906372 0.89 ATP4A (0.34) KDM4EALDH1A1MAPK1SMN1; SMN2CNR2
SCHEMBL20906375 0.86 PDE4B (0.37) KDM4EKCNB1
SCHEMBL20906371 0.83 MMP1 (0.40) KDM4EALDH1A1SMN1; SMN2POLB
SCHEMBL20906379 0.78 CA2 (0.36) ALDH1A1SMN1; SMN2POLB
SCHEMBL20906680 0.77 ADRA2A (0.36) ALDH1A1
SCHEMBL1582351 0.75 MEN1 (0.39) ALDH1A1MAPK1SMN1; SMN2
Water SCHEMBL27748223 0.74 MEN1 (0.38) ALDH1A1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL28407256 0.74 MEN1 (0.38) ALDH1A1MAPK1SMN1; SMN2
SCHEMBL19393368 0.71 ACHE (0.38) ALDH1A1SMN1; SMN2
SCHEMBL14050273 0.70 CA1 (0.44) KDM4EALDH1A1MAPK1SMN1; SMN2POLB

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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