SCHEMBL4580413

SCHEMBL4580413

O=C(OC1(Cc2ccccc2)CCCCC1)c1ccccc1C(=O)OC1(Cc2ccccc2)CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.49
CTSL P07711 4/20 0.49
CTSB P07858 3/20 0.49
CTSS P25774 1/20 0.42
ALDH1A1 P00352 3/20 0.41
ADRB2 P07550 2/20 0.41
HTT P42858 1/20 0.41
SCN1A P35498 1/20 0.40
SCN2A Q99250 1/20 0.40
SCN3A Q9NY46 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
AKR1C1 Q04828 1/20 0.39
HDAC4 P56524 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37

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
SCHEMBL4580415 0.96 ALDH1A1 (0.49) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL4580949 0.88 CTSK (0.49) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL4581480 0.84 CTSK (0.46) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL4580951 0.84 CTSK (0.46) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL7531427 0.83 CTSK (0.50) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL6400218 0.81 TSHR (0.46) CTSKCTSLCTSBALDH1A1SCN1A
SCHEMBL20959847 0.81 CTSK (0.52) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL4581483 0.80 CTSK (0.44) CTSKCTSLCTSBADRB2
SCHEMBL12831362 0.79 CTSK (0.56) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL6399681 0.79 TDP1 (0.44) CTSKCTSLCTSBALDH1A1SCN1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7407686-B2 Optical film, polarizing plate and display device utilising the film, and production method of optical film KONICA CORPORATION (JP) 2008-08-05 US disclosed
US-20060062936-A1 Optical film, polarizing plate and display device utilising the film, and production method of optical film KONICA CORPORATION 2006-03-23 US disclosed
US-20030170482-A1 Optical film, polarizing plate and display device utilizing the film, and production method of optical film KONICA CORPORATION (JP) 2003-09-11 US disclosed