SCHEMBL8735188

SCHEMBL8735188

CCC(C)(C)Nc1cccc(Cl)c1C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPK1 P28482 1/20 0.39
KDM4E B2RXH2 3/20 0.39
CXCL8 P10145 1/20 0.39
ALDH1A1 P00352 4/20 0.38
MAPK10 P53779 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
FEN1 P39748 1/20 0.37

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
SCHEMBL8733043 0.88 POLB (0.46) POLBLMNAMAPTMEN1KMT2A
SCHEMBL8730869 0.82 CDC7 (0.37) POLBLMNAMEN1KMT2AMAPK1
SCHEMBL8732675 0.82 POLB (0.43) POLBLMNAKMT2AALDH1A1
SCHEMBL9017611 0.81 POLB (0.39) POLBLMNAMAPTMEN1KMT2A
SCHEMBL8732664 0.79 CXCL8 (0.45) POLBLMNAMAPTMEN1KMT2A
SCHEMBL8732726 0.78 CLCN2 (0.40) POLBLMNAMEN1KMT2AMAPK1
SCHEMBL7748934 0.76 ALDH1A1 (0.46) POLBLMNAMAPTMEN1KMT2A
SCHEMBL19708737 0.76 MEN1 (0.42) POLBLMNAMEN1KMT2AALDH1A1
SCHEMBL8761584 0.74 KDM4E (0.40) POLBMEN1KMT2AKDM4EALDH1A1
SCHEMBL8733063 0.72 POLB (0.42) POLBLMNAKMT2AALDH1A1

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