SCHEMBL9541212

SCHEMBL9541212

CCOC(=S)c1cc(C)c(F)cc1N

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
HSD17B10 Q99714 2/20 0.33
MAPT P10636 2/20 0.31
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GAA P10253 1/20 0.30
MAPK1 P28482 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
KCNQ3 O43525 1/20 0.30
KCNQ2 O43526 1/20 0.30
KCNQ4 P56696 1/20 0.30
KCNQ5 Q9NR82 1/20 0.30
HTT P42858 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
SCHEMBL9543957 0.80 ALDH1A1 (0.33) ALDH1A1HSD17B10GAAMAPK1
SCHEMBL9540053 0.80 ALDH1A1 (0.33) ALDH1A1HSD17B10MAPTKDM4ENPC1
SCHEMBL23813891 0.72 ALDH1A1 (0.41) ALDH1A1HSD17B10MAPTKDM4ESMN1; SMN2
SCHEMBL9540066 0.71 HSD17B10 (0.35) ALDH1A1HSD17B10MAPTKDM4ENPC1
SCHEMBL11387602 0.70 ALDH1A1 (0.45) ALDH1A1HSD17B10MAPTKDM4ENPC1
SCHEMBL9541207 0.70 SLC6A2 (0.31) ALDH1A1HSD17B10MAPT
SCHEMBL13517391 0.70 UHRF1 (0.40) ALDH1A1HSD17B10MAPTKDM4ENPC1
SCHEMBL5951820 0.69 DGAT1 (0.40) MAPTKDM4EHTT
SCHEMBL24697160 0.69 IKBKE (0.30) MAPK1
SCHEMBL3530679 0.69 KEAP1 (0.50) ALDH1A1HSD17B10MAPTKDM4EGAA

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
WO-1993012795-A1 QUINAZOLIN-4(3H)-ONE DERIVATIVES AS ANTICOCCIDIAL AGENTS GLAZER EDWARD A (US) 1993-07-08 WO disclosed
US-4920224-A CHEMICAL INTERMEDIATES PFIZER INC. (US) 1990-04-24 US disclosed
US-4849518-A ANTIPROTOZOA IN POULTRY PFIZER INC. (US) 1989-07-18 US disclosed
US-4762838-A Quinazolin-4(3H)-one derivatives as anticoccidial agents PFIZER INC. (US) 1988-08-09 US disclosed