SCHEMBL8735192

SCHEMBL8735192

Cc1ccc(N(C)C(C)(C)C)c(C(N)=O)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
CLCN2 P51788 1/20 0.34
RORC P51449 1/20 0.32
RIPK2 O43353 1/20 0.32
TSHR P16473 1/20 0.31
WEE1 P30291 1/20 0.30
EPHB3 P54753 1/20 0.30
PKMYT1 Q99640 1/20 0.30
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
NFKB1 P19838 1/20 0.30
MAPK1 P28482 1/20 0.30
CASP1 P29466 1/20 0.30
RAB9A P51151 1/20 0.30
CASP7 P55210 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 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
SCHEMBL8732688 0.85 POLB (0.33) POLBCLCN2WEE1EPHB3PKMYT1
SCHEMBL8735837 0.76 NPC1 (0.39) POLBKDM4ENPC1ALDH1A1TP53
SCHEMBL4640149 0.72 CLCN2 (0.47) POLBCLCN2TSHRKDM4EALDH1A1
SCHEMBL8735259 0.70 CLCN2 (0.43) POLBCLCN2TSHRKDM4EALDH1A1
SCHEMBL4026715 0.69 POLB (0.42) POLBCLCN2TSHRKDM4ENPC1
SCHEMBL8735058 0.66 CLCN2 (0.40) POLBCLCN2KDM4EALDH1A1MAPT
SCHEMBL8732726 0.66 CLCN2 (0.40) POLBCLCN2KDM4EALDH1A1MAPK1
SCHEMBL31307651 0.64 POLB (0.48) POLBTSHRWEE1PKMYT1KDM4E
SCHEMBL8730848 0.64 CLCN2 (0.41) POLBCLCN2TSHRKDM4EALDH1A1
SCHEMBL7586888 0.63 CLCN2 (0.49) POLBCLCN2TSHRKDM4EALDH1A1

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
EP-0749416-B1 SELECTED BENZAMIDE FUNGICIDES FOR THE CONTROL OF TAKE-ALL DISEASE OF PLANTS MONSANTO CO (US) 1998-12-23 EP disclosed