SCHEMBL3266306

SCHEMBL3266306

Cc1c[nH]nc1C.O=C(O)Cl

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.35
HCAR2 Q8TDS4 2/20 0.32
DAO P14920 1/20 0.32
ALDH1A1 P00352 2/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MCL1 Q07820 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
Succinic Acid SCHEMBL22691726 0.83 NPSR1 (0.39) NOTUMTSHRMAPK1MCL1
Glycolic Acid SCHEMBL28396238 0.83 NOTUM (0.33) NOTUMHCAR2DAOHPGDMCL1
Glycolic Acid SCHEMBL19615736 0.83 NOTUM (0.33) NOTUMHCAR2DAOHPGDMCL1
SCHEMBL28286560 0.83 KCNH2 (0.33)
SCHEMBL152676 0.83
Lactic Acid SCHEMBL28398200 0.82 TP53 (0.42) NOTUMHCAR2ALDH1A1TSHR
Hydrochloric Acid SCHEMBL22691784 0.81
Hydrochloric Acid SCHEMBL8132392 0.81
Phosphine SCHEMBL28098732 0.81
SCHEMBL28286561 0.81

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-2010009847-A1 HETEROCYCLICALLY SUBSTITUTED AMIDES, METHOD FOR THE PRODUCTION THEREOF, AND USE AS HERBICIDES BAYER CROPSCIENCE AG (DE) 2010-01-28 WO disclosed