SCHEMBL26307991

SCHEMBL26307991

COc1ccc(C(=O)Nc2c(C)cc(-c3cc(C)c(NC(=O)c4ccc(OC)c(OC)c4)c(C)c3)cc2C)cc1OC

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 2/20 0.83
▸ PDE4D Q08499 3/20 0.60
▸ PDE4A P27815 1/20 0.58
▸ PDE4B Q07343 1/20 0.58
▸ PDE4C Q08493 1/20 0.58
▸ KMT2A Q03164 4/20 0.57
▸ MEN1 O00255 3/20 0.57
▸ ALDH1A1 P00352 2/20 0.57
▸ POLB P06746 2/20 0.57
▸ KDM4E B2RXH2 1/20 0.56
▸ MAOA P21397 1/20 0.55
▸ MAOB P27338 1/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ MAPT P10636 2/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ ALOX15 P16050 1/20 0.55
▸ RAB9A P51151 3/20 0.54
▸ NPC1 O15118 2/20 0.54
▸ CYP1A2 P05177 2/20 0.53
▸ CYP3A4 P08684 2/20 0.53

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
SCHEMBL8761800 0.91 PKM (1.00) PKMPDE4DPDE4APDE4BPDE4C
SCHEMBL26308271 0.91 PKM (0.70) PKMPDE4DPDE4APDE4BPDE4C
SCHEMBL2887392 0.77 PDE4D (0.66) PKMPDE4DPDE4APDE4BPDE4C
SCHEMBL2887769 0.77 PDE4D (0.63) PKMPDE4DPDE4APDE4BPDE4C
SCHEMBL17664663 0.77 MEN1 (0.72) PKMKMT2AMEN1ALDH1A1POLB
SCHEMBL12682342 0.77 MAPT (0.71) PKMKMT2AMEN1ALDH1A1POLB
SCHEMBL11244161 0.76 PDE4D (0.81) PKMPDE4DKMT2AMEN1ALDH1A1
SCHEMBL14363233 0.76 TP53 (0.68) PKMPDE4DKMT2AMEN1ALDH1A1
SCHEMBL6993698 0.76 CA12 (0.65) PKMKMT2AMEN1ALDH1A1POLB
SCHEMBL2969970 0.75 KDM4E (0.67) PKMPDE4DKMT2AMEN1ALDH1A1

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-2023141467-A2 COMPOSITIONS, METHODS, AND DEVELOPMENT OF ARID4B INHIBITORS UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2023-07-27 — — WO disclosed
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