SCHEMBL10350100

SCHEMBL10350100

CSCC(=O)c1ccco1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 9/20 0.68
ALDH1A1 P00352 9/20 0.68
HSD17B10 Q99714 7/20 0.68
HPGD P15428 5/20 0.68
ALOX15 P16050 5/20 0.68
MAPT P10636 5/20 0.68
L3MBTL1 Q9Y468 3/20 0.68
TDP1 Q9NUW8 3/20 0.68
RECQL P46063 2/20 0.68
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
ESR2 Q92731 2/20 0.57
GAA P10253 2/20 0.57
ALOX12 P18054 1/20 0.57
NR4A1 P22736 1/20 0.57
HTT P42858 1/20 0.57
MCL1 Q07820 1/20 0.57
ESR1 P03372 1/20 0.57
TSHR P16473 1/20 0.57
BLM P54132 1/20 0.57

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
SCHEMBL574955 0.79
SCHEMBL1651850 0.77 CES2 (0.70) POLBALDH1A1HSD17B10HPGDALOX15
SCHEMBL6320074 0.77 ERCC5 (0.74) POLBALDH1A1HSD17B10HPGDALOX15
SCHEMBL1677280 0.77 POLB (0.62) POLBALDH1A1HSD17B10HPGDALOX15
SCHEMBL28243065 0.77 ALDH1A1 (0.62) POLBALDH1A1HSD17B10HPGDALOX15
SCHEMBL5369014 0.75
SCHEMBL51450 0.75
SCHEMBL7070914 0.75 ERCC5 (0.71) POLBALDH1A1HSD17B10HPGDALOX15
SCHEMBL6196587 0.75
SCHEMBL3506264 0.74 CES2 (0.59) POLBALDH1A1HSD17B10HPGDALOX15

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-0201221-B1 6-(1-ACYL-1-HYDROXY METHYL) PENICILLANIC ACID DERIVATIVES PFIZER INC. (US) 1990-08-01 EP disclosed
US-4762921-A 6-(1-acyl-1-hydroxymethyl)penicillanic acid derivatives PFIZER INC. (US) 1988-08-09 US disclosed
US-4675186-A 6-(1-acyl-1-hydroxymethyl)penicillanic acid derivatives PFIZER INC. (US) 1987-06-23 US disclosed
EP-0201221-A1 6-(1-acyl-1-hydroxy methyl) penicillanic acid derivatives PFIZER INC. (US) 1986-11-12 EP disclosed