SCHEMBL3720948

SCHEMBL3720948

Cc1cc(Cl)c(OC(=O)O)c(Cl)n1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.49
MAPK1 P28482 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 2/20 0.43
KMT2A Q03164 5/20 0.41
LMNA P02545 5/20 0.39
MAPT P10636 3/20 0.39
HTT P42858 3/20 0.38
KDM4E B2RXH2 2/20 0.38
PKM P14618 1/20 0.38
GPR35 Q9HC97 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
TPMT P51580 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KMO O15229 1/20 0.33

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
SCHEMBL3729308 0.76 SMN1; SMN2 (0.40) ALDH1A1MAPK1SMN1; SMN2POLBKMT2A
SCHEMBL3227278 0.72 SMN1; SMN2 (0.75) ALDH1A1MAPK1SMN1; SMN2POLBKMT2A
SCHEMBL30593189 0.72 SMN1; SMN2 (0.75) ALDH1A1MAPK1SMN1; SMN2POLBKMT2A
SCHEMBL11608900 0.71 KDM4E (0.46) ALDH1A1MAPK1SMN1; SMN2POLBKMT2A
SCHEMBL18497910 0.71 KDM4E (0.69) ALDH1A1POLBKMT2ALMNAMAPT
SCHEMBL10585533 0.70 LMNA (0.32) ALDH1A1LMNAKMO
SCHEMBL10447737 0.70 CA1 (0.43) ALDH1A1SMN1; SMN2KMT2AKDM4ETPMT
SCHEMBL2924595 0.69 KMT2A (0.50) ALDH1A1MAPK1SMN1; SMN2POLBKMT2A
SCHEMBL9236631 0.69 KDM4E (0.35) ALDH1A1MAPK1SMN1; SMN2POLBKMT2A
SCHEMBL4040049 0.69 ALDH1A1 (0.50) ALDH1A1MAPK1SMN1; SMN2POLBKMT2A

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
WO-2010078906-A2 HYDRAZIDES METHOD FOR PRODUCTION AND USE THEREOF AS HERBICIDE AND INSECTICIDE BAYER CROPSCIENCE AG (DE) 2010-07-15 WO disclosed