SCHEMBL23945318

SCHEMBL23945318

C/C=C/OC(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.54
LMNA P02545 2/20 0.52
F2 P00734 1/20 0.52
ALDH1A1 P00352 5/20 0.46
TDP1 Q9NUW8 4/20 0.46
HSD17B10 Q99714 1/20 0.46
TP53 P04637 1/20 0.44
PLA2G7 Q13093 1/20 0.43
KMT2A Q03164 4/20 0.42
MAPT P10636 3/20 0.42
SLC6A3 Q01959 2/20 0.42
MAPK1 P28482 1/20 0.42
HIF1A Q16665 1/20 0.42
POLB P06746 1/20 0.42
SLC6A2 P23975 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
DAO P14920 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41

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
SCHEMBL628707 1.00 TSHR (0.54) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL2434823 1.00 TSHR (0.54) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL28182671 0.87 LMNA (0.61) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL72654 0.83 TSHR (0.58) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL17714426 0.82 TSHR (0.57) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL3234177 0.82 TSHR (0.57) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL2971855 0.81 LMNA (0.54) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL28041527 0.81 TSHR (0.47) TSHRLMNAALDH1A1TDP1HSD17B10
Benzoic Acid Vinyl Ester SCHEMBL28299446 0.80 TSHR (0.50) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL27757178 0.80 TSHR (0.50) TSHRLMNAF2ALDH1A1TDP1

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
WO-2021211423-A1 METHODS FOR DEPOLYMERIZING POLYESTERS NORTHWESTERN UNIVERSITY (US) 2021-10-21 WO disclosed