SCHEMBL23944614

SCHEMBL23944614

CC(C)(O)C(C)(C)OBc1cc(Cl)cc2oc3cc4cccnc4cc3c12

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.33
PDGFRA P16234 1/20 0.33
NR4A2 P43354 1/20 0.32
CASP6 P55212 1/20 0.30
AHR P35869 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
SCHEMBL23944310 0.97 PDGFRB (0.34) PDGFRBPDGFRANR4A2CASP6AHR
SCHEMBL23943962 0.88 PDGFRB (0.36) PDGFRBPDGFRA
SCHEMBL24066331 0.87 AHR (0.35) AHR
SCHEMBL23944685 0.85 PDGFRB (0.36) PDGFRBPDGFRA
SCHEMBL23947116 0.83 KDM4E (0.33) AHR
SCHEMBL23944668 0.82
SCHEMBL23944684 0.82
SCHEMBL23946705 0.81
SCHEMBL23943961 0.80 IDO1 (0.30)
SCHEMBL22112408 0.79 AHR (0.39) AHR

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-2021210910-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-10-21 WO disclosed