SCHEMBL13372165

SCHEMBL13372165

COc1c(-c2ccccc2)c2ccccc2c2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.58
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ ALDH1A1 P00352 1/20 0.58
▸ MAPK1 P28482 1/20 0.58
▸ PDE4B Q07343 7/20 0.53
▸ PDE4A P27815 5/20 0.53
▸ PDE4C Q08493 5/20 0.53
▸ PDE4D Q08499 5/20 0.53
▸ POLB P06746 1/20 0.47
▸ ABCG2 Q9UNQ0 2/20 0.43
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ IDO1 P14902 1/20 0.42
▸ ACHE P22303 2/20 0.41
▸ PTGER4 P35408 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ ABCC1 P33527 1/20 0.37
▸ ALOX5AP P20292 1/20 0.37
▸ FEN1 P39748 1/20 0.37

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
SCHEMBL29535843 0.85 ALDH1A1 (0.56) KDM4ESMN1; SMN2ALDH1A1MAPK1PDE4B
SCHEMBL283173 0.85 ALDH1A1 (0.56) KDM4ESMN1; SMN2ALDH1A1MAPK1PDE4B
SCHEMBL3723473 0.85 KDM4E (0.56) KDM4ESMN1; SMN2ALDH1A1MAPK1PDE4B
SCHEMBL9812619 0.80 PDE4B (0.61) KDM4ESMN1; SMN2ALDH1A1MAPK1PDE4B
SCHEMBL23751569 0.79 ALDH1A1 (0.44) KDM4ESMN1; SMN2ALDH1A1MAPK1PDE4B
SCHEMBL12181771 0.79 PDE4B (0.71) KDM4ESMN1; SMN2ALDH1A1MAPK1PDE4B
SCHEMBL757747 0.78 KDM4E (0.82) KDM4ESMN1; SMN2ALDH1A1MAPK1PDE4B
SCHEMBL3803312 0.77 PDE4B (0.44) KDM4ESMN1; SMN2ALDH1A1MAPK1PDE4B
SCHEMBL22126649 0.76 KDM4E (0.50) KDM4ESMN1; SMN2ALDH1A1MAPK1PDE4B
SCHEMBL28023834 0.76 PDE4B (0.47) KDM4ESMN1; SMN2ALDH1A1MAPK1PDE4B

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-2010053264-A2 METHOD FOR PREPARING ELASTOMERIC COPOLYMERS OF ETHYLENE AND α-OLEFINS SK ENERGY CO., LTD. (KR) 2010-05-14 — — WO disclosed
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