SCHEMBL25837218

SCHEMBL25837218

COc1cc2c(OCc3ccccc3)cc(C)c(-c3ccccc3)c2cc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSV O60911 2/20 0.46
CTSL P07711 2/20 0.46
CDK5 Q00535 3/20 0.45
CDK5R1 Q15078 3/20 0.45
CDK1 P06493 2/20 0.45
CCNB1 P14635 2/20 0.45
MGAM O43451 1/20 0.44
GAA P10253 1/20 0.44
SI P14410 1/20 0.44
MGAM2 Q2M2H8 1/20 0.44
HPGD P15428 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GSK3B P49841 2/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ELANE P08246 1/20 0.43

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
SCHEMBL25876588 0.87 CDK5 (0.39) CTSVCTSLCDK5CDK5R1CDK1
SCHEMBL25837411 0.87 PTPN1 (0.45) CTSVCTSLCDK5CDK5R1CDK1
SCHEMBL18827135 0.85 GSK3B (0.55) CTSLCDK5CDK5R1GAAHPGD
SCHEMBL25837233 0.85 CTSV (0.46) CTSVCTSLCDK5CDK5R1CDK1
SCHEMBL25876512 0.82 MAOB (0.49) CDK5CDK5R1CDK1CCNB1NPC1
SCHEMBL25876903 0.82 GSK3B (0.51) CTSLCDK5CDK5R1MGAMGAA
SCHEMBL25837150 0.80 MAPT (0.43) CDK5CDK5R1CDK1CCNB1MGAM
SCHEMBL15947070 0.76 CDK5 (0.39) CDK5CDK5R1CDK1CCNB1MGAM
SCHEMBL25837260 0.76 CDK5 (0.40) CTSVCTSLCDK5CDK5R1CDK1
SCHEMBL15763617 0.76 MGAM (0.44) CTSVCTSLCDK5CDK5R1CDK1

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