SCHEMBL4580949

SCHEMBL4580949

O=C(OC1(Cc2ccccc2)CCCCC1)c1ccc(C(=O)OC2(Cc3ccccc3)CCCCC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.49
CTSL P07711 4/20 0.49
CTSB P07858 3/20 0.49
ADRB2 P07550 2/20 0.42
CTSS P25774 1/20 0.42
LMNA P02545 1/20 0.41
KMT2A Q03164 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL4580951 0.96 CTSK (0.46) CTSKCTSLCTSBADRB2CTSS
SCHEMBL4581480 0.90 CTSK (0.46) CTSKCTSLCTSBADRB2CTSS
SCHEMBL24985035 0.88 CTSK (0.44) CTSKCTSLCTSBADRB2CTSS
SCHEMBL4580413 0.88 CTSK (0.49) CTSKCTSLCTSBADRB2CTSS
SCHEMBL4581483 0.86 CTSK (0.44) CTSKCTSLCTSBADRB2CYP2D6
SCHEMBL4580415 0.84 ALDH1A1 (0.49) CTSKCTSLCTSBADRB2CTSS
SCHEMBL7531427 0.83 CTSK (0.50) CTSKCTSLCTSBADRB2CTSS
SCHEMBL20473183 0.82 SLC6A2 (0.43) CTSKCTSLCTSBLMNAKMT2A
SCHEMBL20959847 0.81 CTSK (0.52) CTSKCTSLCTSBCTSSLMNA
SCHEMBL9618428 0.79 LMNA (0.45) CTSKCTSLCTSBLMNAKMT2A

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