SCHEMBL12755486

SCHEMBL12755486

C#CCOC(=O)C(C)(C)CC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.37
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
TSHR P16473 2/20 0.35
CYP1A2 P05177 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CYP2D6 P10635 1/20 0.35
CHRM1 P11229 1/20 0.35
NFKB1 P19838 1/20 0.35
CHRM3 P20309 1/20 0.35
THPO P40225 1/20 0.35
POLB P06746 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 1/20 0.34
PMP22 Q01453 1/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.34
ACHE P22303 1/20 0.31
CA12 O43570 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
SCHEMBL15803987 0.83 TSHR (0.41) CYP4F2CYP4A11TSHR
SCHEMBL379260 0.81 NPC1 (0.38) NPC1TSHRCYP1A2CHRM2CHRM4
SCHEMBL16153798 0.81 L3MBTL1 (0.32) NPC1TSHRL3MBTL1ZDHHC20ACHE
SCHEMBL2478567 0.80 NPC1 (0.41) NPC1TSHRCYP1A2CHRM2CHRM4
SCHEMBL27657800 0.80 NPC1 (0.41) NPC1TSHRCYP1A2CHRM2CHRM4
SCHEMBL10012307 0.79 NPC1 (0.34) NPC1
SCHEMBL17914698 0.79 NPC1 (0.34) NPC1TSHRPOLBL3MBTL1ZDHHC20
SCHEMBL4677677 0.78 NPC1 (0.39) NPC1TSHRCYP1A2CHRM2CHRM4
SCHEMBL16815032 0.78 NPC1 (0.39) NPC1TSHRCYP1A2CHRM2CHRM4
SCHEMBL4677672 0.78 NPC1 (0.39) NPC1TSHRCYP1A2CHRM2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230330659-A1 SUBSTRATE WITH ORTHOGONALLY FUNCTIONAL NANODOMAINS ILLUMINA CAMBRIDGE LIMITED (GB) 2023-10-19 US disclosed
EP-3070110-A1 POLYMERS HAVING ORTHOGONAL REACTIVE GROUPS AND USES THEREOF NVS Technologies Inc. (US) 2016-09-21 EP disclosed
US-20140170405-A1 PROCESSES FOR PREPARING CURED FILMS, THE RESULTING FILMS, AND PLASMA-INITIATED POLYMERIZABLE COMPOSITIONS FUJIFILM CORPORATION (JP) 2014-06-19 US disclosed
US-20110074896-A1 INK COMPOSITION AND METHOD OF PRODUCING A PROCESSED PRODUCT OF PRINTED MATTER FUJIFILM CORPORATION (JP) 2011-03-31 US disclosed