SCHEMBL24711534

SCHEMBL24711534

NC(C(=O)O)c1cc(O)c(O)c(O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.58
▸ TDP1 Q9NUW8 7/20 0.58
▸ HSD17B10 Q99714 6/20 0.58
▸ ALDH1A1 P00352 6/20 0.58
▸ GRM1 Q13255 6/20 0.58
▸ HPGD P15428 5/20 0.58
▸ MEN1 O00255 5/20 0.58
▸ KMT2A Q03164 5/20 0.58
▸ CYP2C9 P11712 3/20 0.58
▸ GRM2 Q14416 2/20 0.58
▸ CYP2C19 P33261 2/20 0.53
▸ CYP2D6 P10635 1/20 0.47
▸ GRM8 O00222 1/20 0.47
▸ GRM6 O15303 1/20 0.47
▸ SLC6A2 P23975 1/20 0.47
▸ SLC6A4 P31645 1/20 0.47
▸ DRD3 P35462 1/20 0.47
▸ GRM4 Q14833 1/20 0.47
▸ LMNA P02545 4/20 0.44
▸ MAPT P10636 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
SCHEMBL16272411 0.86 GRM1 (0.50) KDM4ETDP1HSD17B10ALDH1A1GRM1
SCHEMBL23129230 0.83 MEN1 (0.56) KDM4ETDP1HSD17B10ALDH1A1GRM1
SCHEMBL18326526 0.83 GRM1 (0.55) KDM4ETDP1HSD17B10ALDH1A1GRM1
SCHEMBL5287095 0.83 HSD17B10 (0.46) KDM4ETDP1HSD17B10ALDH1A1GRM1
SCHEMBL12648300 0.83 GRM1 (0.55) KDM4ETDP1HSD17B10ALDH1A1GRM1
SCHEMBL4314455 0.79 KDM4E (0.50) KDM4ETDP1HSD17B10ALDH1A1GRM1
SCHEMBL1512962 0.79 KDM4E (0.50) KDM4ETDP1HSD17B10ALDH1A1GRM1
SCHEMBL12648471 0.79 KDM4E (0.50) KDM4ETDP1HSD17B10ALDH1A1GRM1
SCHEMBL449665 0.78 TDP1 (0.70) KDM4ETDP1HSD17B10ALDH1A1GRM1
SCHEMBL3478437 0.78 TDP1 (0.70) KDM4ETDP1HSD17B10ALDH1A1GRM1

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-20230001046-A1 BIOCOMPATIBLE ADHESIVES AND METHODS OF MANUFACTURE THEREOF GOVERNING COUNCIL UNIV TORONTO (CA) 2023-01-05 — — US disclosed
WO-2022261791-A1 AMPHIPHILIC OLIGOMERS AND SELF-ASSEMBLING HYDROGELS FORMED THEREFROM THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2022-12-22 — — WO disclosed
US-20220395608-A1 WATER SOLUBLE BIOADHESIVES GOVERNING COUNCIL UNIV TORONTO (CA) 2022-12-15 — — US disclosed
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