SCHEMBL7057721

SCHEMBL7057721

CC(C)O[CH]Oc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.39
LMNA P02545 2/20 0.38
LTA4H P09960 2/20 0.36
TSHR P16473 1/20 0.36
PTGS1 P23219 2/20 0.34
MAOA P21397 1/20 0.34
ALDH1A1 P00352 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SIRT1 Q96EB6 1/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.32
KCNA3 P22001 1/20 0.31
MTNR1A P48039 2/20 0.31
MTNR1B P49286 2/20 0.31
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
CYP2D6 P10635 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
SCHEMBL6606014 0.77 LTA4H (0.50) CA4LMNALTA4HTSHRMAOA
SCHEMBL28369275 0.75 LTA4H (0.47) CA4LMNALTA4HTSHRMAOA
SCHEMBL1543834 0.73 CA4 (0.50) CA4LMNALTA4HTSHRKCNA3
SCHEMBL1042354 0.71 CA4 (0.42) CA4LMNALTA4HTSHRPTGS1
SCHEMBL29191681 0.68 ALDH1A3 (0.52) LMNAALDH1A1SIRT1MEN1TP53
SCHEMBL7054396 0.68 TSHR (0.43) LMNATSHRMAOAALDH1A1L3MBTL1
SCHEMBL1262500 0.68 LMNA (0.47) CA4LMNALTA4HTSHRPTGS1
SCHEMBL8211743 0.68 CA4 (0.39) CA4LMNALTA4HTSHRPTGS1
SCHEMBL712888 0.68 CA4 (0.39) CA4LMNALTA4HTSHRALDH1A1
SCHEMBL6002697 0.68 LTA4H (0.43) CA4LTA4HTSHRALDH1A1L3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1304325-A1 5-(M-CYANOBENZYLAMINO)PYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-04-23 EP disclosed
US-5332656-A Yellow couplers MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-07-26 US disclosed