SCHEMBL7056940

SCHEMBL7056940

C=CC(=O)OCCOC(=O)Nc1ccc(C)cc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.54
PKM P14618 1/20 0.50
SMN1; SMN2 Q16637 5/20 0.48
ALDH1A1 P00352 4/20 0.48
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
HSD17B10 Q99714 2/20 0.48
LMNA P02545 1/20 0.48
RECQL P46063 1/20 0.48
MAPT P10636 1/20 0.47
POLB P06746 1/20 0.46
MAPK1 P28482 1/20 0.46
THRB P10828 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
TSHR P16473 3/20 0.44
TP53 P04637 2/20 0.44
HIF1A Q16665 2/20 0.44

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
SCHEMBL23463468 0.85 RAB9A (0.48) SMN1; SMN2ALDH1A1NPC1RAB9ALMNA
SCHEMBL11510166 0.85 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1NPC1RAB9AHSD17B10
SCHEMBL3203115 0.84 NPC1 (0.62) TGM2SMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL22647990 0.84 RAB9A (0.64) SMN1; SMN2ALDH1A1NPC1RAB9ALMNA
SCHEMBL23422448 0.84 THRB (0.56) SMN1; SMN2ALDH1A1NPC1RAB9ARECQL
SCHEMBL3210606 0.84 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1NPC1RAB9AHSD17B10
SCHEMBL17107937 0.84 NPC1 (0.49) SMN1; SMN2ALDH1A1NPC1RAB9AHSD17B10
SCHEMBL14085640 0.84 BCHE (0.47) SMN1; SMN2ALDH1A1NPC1RAB9AHSD17B10
SCHEMBL11511366 0.83 NPC1 (0.49) SMN1; SMN2ALDH1A1NPC1RAB9AHSD17B10
SCHEMBL23422351 0.82 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1NPC1RAB9AHSD17B10

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-20220153895-A1 SUBSTITUTED PROPANE-CORE MONOMERS AND POLYMERS THEREOF FOR VOLUME BRAGG GRATINGS META PLATFORMS TECHNOLOGIES, LLC 2022-05-19 US disclosed
WO-2003062287-A1 (METH)ACRYLATE COMPOSITIONS HAVING A SELF-INDICATOR OF CURE AND METHODS OF DETECTING CURE HENKEL CORPORATION (US) 2003-07-31 WO disclosed
WO-2003035703-A1 NON-FLAMMABLE AND NON-COMBUSTIBLE ADHESIVE BONDING SYSTEMS HAVING ADHERENCE TO LOW ENERGY SURFACES HENKEL CORPORATION (US) 2003-05-01 WO disclosed