SCHEMBL16360481

SCHEMBL16360481

CC1(C)CC(C)(C)CC2(C1)c1ccccc1-c1c2cc(O)c2cc(C34CC5CC(CC(C5)C3)C4)c(N3CCOCC3)cc12

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
MAPT P10636 1/20 0.30
ATM Q13315 1/20 0.30
BRD4 O60885 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
SCHEMBL12635768 0.85
SCHEMBL16360479 0.83
SCHEMBL4568665 0.82 ALDH1A1 (0.32) NPSR1ALDH1A1MEN1KMT2AMAPT
SCHEMBL16300276 0.82 ALDH1A1 (0.32) NPSR1ALDH1A1MEN1KMT2AMAPT
SCHEMBL12635769 0.82
SCHEMBL4568680 0.81 ALK (0.32) MEN1KMT2AMAPTBRD4
SCHEMBL10267942 0.81 PDK2 (0.37) ALDH1A1MAPT
SCHEMBL12634359 0.80 CNR2 (0.34) MEN1KMT2A
SCHEMBL10261936 0.79 PDK2 (0.37) NPSR1ALDH1A1MAPT
SCHEMBL10262023 0.79 PDK2 (0.32) ALDH1A1MAPT

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-2011078030-A1 CHROMENE COMPOUND 株式会社トクヤマ (JP) 2011-06-30 WO disclosed