SCHEMBL8425155

SCHEMBL8425155

CC(=O)Nc1ccc(CC(O)O)cn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.54
GAA P10253 2/20 0.49
CYP1A2 P05177 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.44
KMT2A Q03164 2/20 0.43
TDP1 Q9NUW8 1/20 0.42
DEGS1 O15121 1/20 0.41
TDO2 P48775 1/20 0.41
CPB2 Q96IY4 1/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
NSD2 O96028 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
GRIN2B Q13224 1/20 0.40
PDE4A P27815 1/20 0.39
USP7 Q93009 1/20 0.39
MEN1 O00255 1/20 0.39
MAPK8 P45983 1/20 0.38

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
SCHEMBL31267199 0.83 HSD17B10 (0.51) PTK2GAACYP1A2KMT2ATDP1
SCHEMBL31267203 0.83 HSD17B10 (0.51) PTK2GAACYP1A2KMT2ATDP1
SCHEMBL3306300 0.81 PTK2 (0.59) PTK2GAACYP1A2L3MBTL1KMT2A
SCHEMBL2759546 0.81 PTK2 (0.59) PTK2GAACYP1A2L3MBTL1KMT2A
SCHEMBL9455571 0.80 PTK2 (0.62) PTK2GAACYP1A2L3MBTL1KMT2A
SCHEMBL2642701 0.80 PTK2 (0.57) PTK2GAACYP1A2L3MBTL1KMT2A
SCHEMBL2642704 0.80 PTK2 (0.57) PTK2GAACYP1A2L3MBTL1KMT2A
SCHEMBL4550164 0.80 PTK2 (0.57) PTK2GAACYP1A2L3MBTL1KMT2A
SCHEMBL13369510 0.80 PTK2 (0.57) PTK2GAACYP1A2L3MBTL1KMT2A
SCHEMBL3981252 0.79 PTK2 (0.56) PTK2GAACYP1A2L3MBTL1KMT2A

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
US-6001856-A β-adrenergic agonists to reduce a wasting condition PFIZER INC. (US) 1999-12-14 US disclosed