SCHEMBL12623866

SCHEMBL12623866

C=C(C)C(=O)OCCCCCCCC(C)(C)CC

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.64
THRB P10828 1/20 0.47
TDP1 Q9NUW8 2/20 0.46
HTT P42858 2/20 0.46
POLB P06746 1/20 0.46
APEX1 P27695 1/20 0.46
FFAR1 O14842 1/20 0.36
CPT2 P23786 1/20 0.36
NAAA Q02083 1/20 0.34
ALDH1A1 P00352 4/20 0.34
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
RAD52 P43351 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
EPHX1 P07099 1/20 0.33
CYP3A4 P08684 1/20 0.32
ACHE P22303 3/20 0.32

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
SCHEMBL12623794 0.93 TSHR (0.58) TSHRTHRBTDP1HTTPOLB
SCHEMBL12257042 0.85 TSHR (0.53) TSHRTHRBTDP1HTTPOLB
SCHEMBL29733357 0.85 TSHR (0.66) TSHRTHRBTDP1HTTPOLB
SCHEMBL12200942 0.84 TSHR (0.65) TSHRTHRBTDP1HTTPOLB
SCHEMBL22554429 0.82 TSHR (0.83) TSHRTHRBTDP1HTTPOLB
SCHEMBL22554423 0.82 TSHR (0.83) TSHRTHRBTDP1HTTPOLB
SCHEMBL22554404 0.82 TSHR (0.83) TSHRTHRBTDP1HTTPOLB
SCHEMBL22554400 0.82 TSHR (0.83) TSHRTHRBTDP1HTTPOLB
SCHEMBL22023212 0.82 TSHR (0.83) TSHRTHRBTDP1HTTPOLB
SCHEMBL22554406 0.82 TSHR (0.83) TSHRTHRBTDP1HTTPOLB

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
US-8735026-B2 Polymerizable composition, light-blocking color filter for solid-state imaging device, and solid-state imaging device FUJIFILM CORPORATION (JP) 2014-05-27 US disclosed
US-20110104596-A1 POLYMERIZABLE COMPOSITION, LIGHT-BLOCKING COLOR FILTER FOR SOLID-STATE IMAGING DEVICE, AND SOLID-STATE IMAGING DEVICE FUJIFILM CORPORATION (JP) 2011-05-05 US disclosed