SCHEMBL8769007

SCHEMBL8769007

COc1ccc(OC)c(C(=O)C=Cc2ccc(O)c(O)c2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.80
PDE4A P27815 1/20 0.78
PDE4B Q07343 1/20 0.78
PDE4C Q08493 1/20 0.78
PDE4D Q08499 1/20 0.78
FLT3 P36888 1/20 0.69
MEN1 O00255 1/20 0.68
LMNA P02545 1/20 0.68
HPGD P15428 1/20 0.68
KMT2A Q03164 1/20 0.68
MAOB P27338 1/20 0.67
CTSL P07711 1/20 0.65

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
SCHEMBL31611889 1.00 ABCG2 (0.80) ABCG2PDE4APDE4BPDE4CPDE4D
SCHEMBL8769002 1.00 ABCG2 (0.80) ABCG2PDE4APDE4BPDE4CPDE4D
SCHEMBL30383668 0.90 ABCG2 (0.80) ABCG2FLT3MEN1LMNAHPGD
SCHEMBL4969738 0.90 ABCG2 (0.80) ABCG2FLT3MEN1LMNAHPGD
SCHEMBL13696689 0.90 ABCG2 (0.80) ABCG2FLT3MEN1LMNAHPGD
SCHEMBL633909 0.88 PDE4A (1.00) ABCG2PDE4APDE4BPDE4CPDE4D
SCHEMBL633910 0.88 PDE4A (1.00) ABCG2PDE4APDE4BPDE4CPDE4D
SCHEMBL633045 0.88 ABCG2 (0.97) ABCG2PDE4APDE4BPDE4CPDE4D
SCHEMBL633046 0.88 ABCG2 (0.97) ABCG2PDE4APDE4BPDE4CPDE4D
SCHEMBL634098 0.87 PDE4A (0.82) ABCG2PDE4APDE4BPDE4CPDE4D

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0629602-B1 3,4-Dihydroxychalcone derivatives NIPPON HYPOX LAB INC (JP) 1997-09-10 EP disclosed
EP-0629602-A1 3,4-Dihydroxychalcone derivatives NIPPON HYPOX LABORATORIES INCORPORATED (JP) 1994-12-21 EP disclosed
US-5276058-A Antiinflammatory agents NIPPON HYPOX LABORATORIES INCORPORATED (JP) 1994-01-04 US disclosed