SCHEMBL19300037

SCHEMBL19300037

CC(=O)c1cnn(Cc2ccc(O)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.51
LMNA P02545 4/20 0.48
ALDH1A1 P00352 3/20 0.48
MAPT P10636 3/20 0.48
HTT P42858 2/20 0.48
MAPK1 P28482 1/20 0.48
KLKB1 P03952 8/20 0.48
KDM4E B2RXH2 2/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HSD17B1 P14061 1/20 0.46
KLK1 P06870 2/20 0.44
L3MBTL1 Q9Y468 3/20 0.43
POLB P06746 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL17229366 0.89 KLKB1 (0.51) HSD17B10LMNAALDH1A1MAPTHTT
SCHEMBL27364232 0.89 KLKB1 (0.53) HSD17B10LMNAALDH1A1MAPTHTT
SCHEMBL752774 0.88 LMNA (0.61) HSD17B10LMNAALDH1A1MAPTHTT
SCHEMBL27286142 0.88 HSD17B10 (0.68) HSD17B10LMNAALDH1A1MAPTHTT
SCHEMBL13692389 0.87 L3MBTL1 (0.54) HSD17B10LMNAALDH1A1MAPTHTT
SCHEMBL27259482 0.86 KLKB1 (0.51) HSD17B10LMNAALDH1A1MAPTHTT
SCHEMBL19299982 0.85 HSD17B10 (0.65) HSD17B10LMNAALDH1A1MAPTKLKB1
SCHEMBL17454410 0.85 L3MBTL1 (0.58) HSD17B10LMNAALDH1A1MAPTHTT
SCHEMBL19300042 0.84 HSD17B10 (0.49) HSD17B10LMNAALDH1A1MAPTHTT
SCHEMBL27286146 0.84 MAOB (0.47) HSD17B10LMNAALDH1A1MAPTHTT

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-2017144995-A1 PYRAZOLO[1,5-A]PYRAZIN-4-YL DERIVATIVES AS JAK-INHIBITORS PFIZER INC. (US) 2017-08-31 WO disclosed