SCHEMBL29412940

SCHEMBL29412940

COc1ccc(C(=O)c2nccc3cc(OC)c(OC)cc23)cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 4/20 1.00
SENP6 Q9GZR1 4/20 1.00
SENP8 Q96LD8 3/20 1.00
SENP7 Q9BQF6 3/20 1.00
APAF1 O14727 2/20 1.00
NSD2 O96028 2/20 1.00
L3MBTL1 Q9Y468 2/20 1.00
KDM4E B2RXH2 2/20 0.70
TDP2 O95551 1/20 0.64
PPP1CA P62136 1/20 0.64
SAE1 Q9UBE0 1/20 0.64
UBA2 Q9UBT2 1/20 0.64
LMNA P02545 3/20 0.59
CYP3A4 P08684 3/20 0.57
CYP1A2 P05177 2/20 0.57
CYP2C9 P11712 2/20 0.57
TSHR P16473 2/20 0.57
CYP2C19 P33261 2/20 0.57
IGFBP3 P17936 2/20 0.55
PDE10A Q9Y233 5/20 0.50

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
SCHEMBL679695 1.00 CASP3 (1.00) CASP3SENP6SENP8SENP7APAF1
SCHEMBL194997 0.91 CASP3 (0.83) CASP3SENP6SENP8SENP7APAF1
SCHEMBL21690572 0.88 CASP3 (0.79) CASP3SENP6SENP8SENP7APAF1
SCHEMBL23457757 0.88 CASP3 (0.78) CASP3SENP6SENP8SENP7APAF1
SCHEMBL23458028 0.88 CASP3 (0.78) CASP3SENP6SENP8SENP7APAF1
SCHEMBL21690569 0.87 CASP3 (0.77) CASP3SENP6SENP8SENP7APAF1
SCHEMBL23458036 0.86 CASP3 (0.76) CASP3SENP6SENP8SENP7APAF1
SCHEMBL23457440 0.85 CASP3 (0.74) CASP3SENP6SENP8SENP7APAF1
SCHEMBL2463171 0.83 CASP3 (0.71) CASP3SENP6SENP8SENP7APAF1
SCHEMBL21690825 0.83 CASP3 (0.70) CASP3SENP6SENP8SENP7APAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116322353-A Anticoccidial composition comprising ginkgo leaf and use thereof CJ第一制糖株式会社 2023-06-23 CN disclosed
CN-115975981-A Xanthomonas disease-resistant related protein and coding gene and application thereof 中国农业大学 2023-04-18 CN disclosed