SCHEMBL23944612

SCHEMBL23944612

CC(C)(O)C(C)(C)OBc1cccc2oc3cc4ccncc4cc3c12

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 1/20 0.33
GRM4 Q14833 1/20 0.31
HASPIN Q8TF76 2/20 0.31
CYP19A1 P11511 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
SCHEMBL23944682 1.00 CLK1 (0.33) CLK1GRM4HASPINCYP19A1
SCHEMBL27255262 0.89 KMT2A (0.32)
SCHEMBL23944684 0.86
SCHEMBL23944668 0.86
SCHEMBL23947344 0.85 ROCK2 (0.31)
SCHEMBL23946634 0.85 ADRB2 (0.30)
SCHEMBL23944627 0.83
SCHEMBL23943955 0.83
SCHEMBL23944685 0.83 PDGFRB (0.36) GRM4
SCHEMBL23943891 0.82

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