SCHEMBL25837352

SCHEMBL25837352

CC1(C)Oc2cc3c(-c4ccccc4)c(I)cc(OCc4ccccc4)c3cc2S1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 5/20 0.37
CDK5 Q00535 5/20 0.37
CDK5R1 Q15078 5/20 0.37
CDK1 P06493 5/20 0.34
CCNB1 P14635 5/20 0.34
CCNE2 O96020 1/20 0.34
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34
BRD4 O60885 1/20 0.32
FFAR1 O14842 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAOB P27338 1/20 0.32
PIN1 Q13526 1/20 0.31
CCR5 P51681 1/20 0.31
ALOX5AP P20292 1/20 0.31
F9 P00740 1/20 0.31
F10 P00742 1/20 0.31

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
SCHEMBL25837349 0.89 GSK3B (0.38) GSK3BCDK5CDK5R1CDK1CCNB1
SCHEMBL15490897 0.80 GSK3B (0.35) GSK3BCDK5CDK5R1CDK1CCNB1
SCHEMBL10041199 0.77 CDK5 (0.39) GSK3BCDK5CDK5R1CDK1CCNB1
SCHEMBL25837233 0.77 CTSV (0.46) GSK3BCDK5CDK5R1CDK1CCNB1
SCHEMBL17736783 0.75 FFAR1 (0.43) GSK3BCDK5CDK5R1CDK1CCNB1
SCHEMBL4568722 0.75 MAPT (0.38) GSK3BCDK5CDK5R1CDK1CCNB1
SCHEMBL18827134 0.74 GSK3B (0.54) GSK3BCDK5CDK5R1MAPTMAOB
SCHEMBL17736807 0.73 MAPT (0.42) GSK3BCDK5CDK5R1CDK1CCNB1
SCHEMBL13556815 0.73 BRD4 (0.36) GSK3BCDK5CDK5R1CDK1CCNB1
SCHEMBL15449614 0.72 PIN1 (0.39) GSK3BCDK5CDK5R1CDK1CCNB1

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-2023136213-A1 PHOTOCHROMIC COMPOUND, NAPHTHOL DERIVATIVE, CURABLE COMPOSITION, OPTICAL ARTICLE, LENS, AND EYEGLASSES 株式会社トクヤマ 2023-07-20 WO disclosed