SCHEMBL7077978

SCHEMBL7077978

C=C(CC=C(CCC(=O)OC)C(=O)O)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
LMNA P02545 3/20 0.34
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 1/20 0.33
KMT2A Q03164 2/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CPB1 P15086 1/20 0.32
TET2 Q6N021 1/20 0.31
MEN1 O00255 1/20 0.31
CA12 O43570 1/20 0.30
CA14 Q9ULX7 1/20 0.30

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
SCHEMBL7564628 0.83 CAMK2A (0.31) ALDH1A1
SCHEMBL4331985 0.83 APEX1 (0.40) TSHRALDH1A1
SCHEMBL2879158 0.81 ALDH1A1 (0.34) ALDH1A1
SCHEMBL1345247 0.81 APEX1 (0.40) TSHRALDH1A1KMT2AHSD17B10MEN1
SCHEMBL1403008 0.80 KDM4A (0.33)
SCHEMBL16353565 0.80 APEX1 (0.38)
Acrylic Acid SCHEMBL11334142 0.78 ALOX15 (0.37) TSHRHSD17B10
SCHEMBL1504266 0.78 ALDH1A1 (0.42) TSHRALDH1A1
Itaconate SCHEMBL8029792 0.78 ALOX15 (0.40) HSD17B10
Methacrylic Acid SCHEMBL6560561 0.77 ALDH1A1 (0.39) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030225230-A1 Polymers for antifouling coatings and a process for the preparation thereof JOTUN A/S 2003-12-04 US disclosed