SCHEMBL11364482

SCHEMBL11364482

CNC(=O)Oc1ccc(C(N)=O)cc1OC(C)C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.61
ACHE P22303 1/20 0.61
PARP10 Q53GL7 1/20 0.47
TOP2A P11388 2/20 0.45
KDM4E B2RXH2 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
IRAK4 Q9NWZ3 2/20 0.42
MAPK1 P28482 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
PDE4B Q07343 2/20 0.41
MAPT P10636 1/20 0.40
POLB P06746 1/20 0.39
FLT3 P36888 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
BCL2L1 Q07817 1/20 0.38
PDE4A P27815 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
SCHEMBL7325813 0.85 PARP10 (0.59) ALDH1A1PARP10TOP2AKMT2AIRAK4
SCHEMBL4277719 0.82 MAPK1 (0.59) ALDH1A1PARP10TOP2AIRAK4MAPK1
SCHEMBL15521569 0.78 PARP10 (0.51) PARP10TOP2AKDM4EIRAK4MAPK1
Propoxur SCHEMBL7591934 0.78 ALDH1A1 (0.88) ALDH1A1ACHEKDM4EKMT2AL3MBTL1
SCHEMBL24812339 0.77 MAPK1 (0.62) ALDH1A1PARP10KMT2AMAPK1PDE4B
Propoxur SCHEMBL6357408 0.77 ALDH1A1 (1.00) ALDH1A1ACHEKDM4EKMT2AL3MBTL1
Propoxur SCHEMBL27794 0.77 ALDH1A1 (1.00) ALDH1A1ACHEKDM4EKMT2AL3MBTL1
SCHEMBL27775177 0.77 ALDH1A1 (0.65) ALDH1A1ACHEKDM4EKMT2AL3MBTL1
SCHEMBL16605596 0.75 PARP10 (0.56) ALDH1A1PARP10TOP2AKMT2AIRAK4
SCHEMBL23606802 0.75 PARP10 (0.56) ALDH1A1PARP10TOP2AKMT2AIRAK4

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-4286020-A BY SPRAYING A FILM FORMING POLYMER OF POLYVINYL ACETATE, POLYVINYL ETHER OR AN ACRYLIC POLYMER ENVIRONMENTAL CHEMICALS, INC. (US) 1981-08-25 US disclosed