SCHEMBL4581483

SCHEMBL4581483

O=C(O)c1cccc(C(=O)OC2(Cc3ccccc3)CCCCC2)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.44
CTSL P07711 3/20 0.44
CTSB P07858 3/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
HIF1A Q16665 1/20 0.44
NR4A2 P43354 2/20 0.43
FOLH1 Q04609 1/20 0.41
ADRB2 P07550 1/20 0.40
KDM4E B2RXH2 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MRGPRX4 Q96LA9 5/20 0.39

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
SCHEMBL4581480 0.96 CTSK (0.46) CTSKCTSLCTSBCYP2D6CYP2C9
SCHEMBL4580951 0.88 CTSK (0.46) CTSKCTSLCTSBCYP2D6CYP2C9
SCHEMBL4580949 0.86 CTSK (0.49) CTSKCTSLCTSBCYP2D6CYP2C9
SCHEMBL28210207 0.84 CYP2D6 (0.40) CYP2D6CYP2C9HIF1ANR4A2FOLH1
SCHEMBL4580413 0.80 CTSK (0.49) CTSKCTSLCTSBADRB2
SCHEMBL4580415 0.80 ALDH1A1 (0.49) CTSKCTSLCTSBCYP2D6CYP2C9
SCHEMBL4580643 0.77 AKR1C3 (0.41) CYP2D6CYP2C9HIF1AKDM4ENPSR1
SCHEMBL7531427 0.76 CTSK (0.50) CTSKCTSLCTSBADRB2
SCHEMBL24985035 0.75 CTSK (0.44) CTSKCTSLCTSBCYP2D6CYP2C9
SCHEMBL20473183 0.75 SLC6A2 (0.43) CTSKCTSLCTSBCYP2D6CYP2C9

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