SCHEMBL10607461

SCHEMBL10607461

CNc1ccccc1OC(C)=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.53
KDM4E B2RXH2 3/20 0.53
HSD17B10 Q99714 3/20 0.53
ALDH1A1 P00352 1/20 0.53
ESR1 P03372 1/20 0.53
ITGB3 P05106 1/20 0.53
ITGA2B P08514 1/20 0.53
HMGB1 P09429 1/20 0.53
HPGD P15428 1/20 0.53
TSHR P16473 1/20 0.53
GGT1 P19440 1/20 0.53
PTGS1 P23219 1/20 0.53
BLM P54132 1/20 0.53
NAPRT Q6XQN6 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
TOP1 P11387 2/20 0.50
POLB P06746 1/20 0.48
ATM Q13315 1/20 0.48
LMNA P02545 1/20 0.47
CYP1A2 P05177 1/20 0.47

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
SCHEMBL31482993 1.00 PTGS2 (0.53) PTGS2KDM4EHSD17B10ALDH1A1ESR1
SCHEMBL6971901 0.84 KDM4E (0.48) KDM4EHSD17B10ALDH1A1HPGDPTGS1
SCHEMBL693858 0.83 ACHE (0.56) PTGS2KDM4EHSD17B10ALDH1A1ESR1
SCHEMBL8886874 0.82 HSD17B10 (0.66) PTGS2KDM4EHSD17B10ALDH1A1ESR1
SCHEMBL10499249 0.82 PTGS2 (0.52) PTGS2KDM4EHSD17B10ALDH1A1ESR1
SCHEMBL338196 0.80 PTGS2 (0.68) PTGS2KDM4EHSD17B10ALDH1A1ESR1
SCHEMBL29432883 0.80 PTGS2 (0.68) PTGS2KDM4EHSD17B10ALDH1A1ESR1
SCHEMBL24260340 0.79 TOP1 (0.50) PTGS2KDM4EHSD17B10ALDH1A1ESR1
SCHEMBL361663 0.79 MAPT (0.59) PTGS2KDM4EHSD17B10ALDH1A1ESR1
SCHEMBL24260332 0.79 HSD17B10 (0.46) KDM4EHSD17B10ALDH1A1ESR1POLB

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
EP-4238571-A1 APPLICATION OF THYMIDINE DERIVATIVE IN PREPARATION OF DRUGS OnQuality Pharmaceuticals China Ltd. (CN) 2023-09-06 EP disclosed
EP-0183207-B1 POROUS GLASS FIBERS WITH IMMOBILIZED BIOCHEMICALLY ACTIVE MATERIAL PPG INDUSTRIES, INC. (US) 1989-09-20 EP disclosed
US-4748121-A Porous glass fibers with immobilized biochemically active material PPG INDUSTRIES, INC. (US) 1988-05-31 US disclosed
EP-0183207-A1 Porous glass fibers with immobilized biochemically active material PPG INDUSTRIES, INC. (US) 1986-06-04 EP disclosed