SCHEMBL8314829

SCHEMBL8314829

CC(c1ccccc1)C(C)(C)C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.48
KMT2A Q03164 1/20 0.48
ALOX5 P09917 2/20 0.47
LMNA P02545 2/20 0.43
AOC3 Q16853 1/20 0.43
PTGS2 P35354 1/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2C P18825 1/20 0.41
HIF1A Q16665 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP2D6 P10635 2/20 0.40
NOS2 P35228 1/20 0.40
SRC P12931 1/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL22418804 0.83 L3MBTL1 (0.43) KMT2AALOX5LMNAAOC3TDP1
SCHEMBL173884 0.83 L3MBTL1 (0.43) KMT2AALOX5LMNAAOC3TDP1
SCHEMBL14246913 0.82 KMT2A (0.47) MAPTKMT2AALOX5LMNAADRA2A
SCHEMBL6017678 0.82 MAPT (0.50) MAPTKMT2AALOX5LMNAAOC3
SCHEMBL2439195 0.82 L3MBTL1 (0.42) KMT2AALOX5LMNAAOC3TDP1
SCHEMBL2439196 0.82 L3MBTL1 (0.42) KMT2AALOX5LMNAAOC3TDP1
SCHEMBL16892954 0.82 ALOX5 (0.48) MAPTKMT2AALOX5LMNAADRA2A
SCHEMBL2439193 0.82 L3MBTL1 (0.42) KMT2AALOX5LMNAAOC3TDP1
SCHEMBL28810022 0.81 ROCK2 (0.41) KMT2ALMNAPTGS2L3MBTL1CYP1A2
SCHEMBL17520105 0.81 MAPT (0.46) MAPTKMT2AALOX5LMNAAOC3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0730587-B1 3-PHENYL-2-ISOXAZOLINES AS ANTIINFLAMMATORY AGENTS PFIZER (US) 1999-12-08 EP disclosed
US-5686434-A PHOSPHODIESTERASE TYPE IV INHIBITORS PFIZER INC. (US) 1997-11-11 US disclosed