SCHEMBL10401003

SCHEMBL10401003

Cc1ccc(Cl)cc1N(C(N)=O)c1nc2c(c(C(F)(F)F)n1)CCCC2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPT P10636 6/20 0.37
POLB P06746 4/20 0.37
ACHE P22303 5/20 0.36
BCHE P06276 4/20 0.36
CHRM1 P11229 1/20 0.36
EPHX2 P34913 1/20 0.36
TP53 P04637 4/20 0.35
PDE4B Q07343 1/20 0.35
RECQL P46063 1/20 0.35
CASP6 P55212 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GRIN1 Q05586 2/20 0.35
GRIN2A Q12879 2/20 0.35
TSHR P16473 3/20 0.35
LMNA P02545 2/20 0.35
HTT P42858 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL9539991 0.91 HPGD (0.36) L3MBTL1SMN1; SMN2MAPTPOLBACHE
SCHEMBL9536972 0.90 ACHE (0.37) L3MBTL1SMN1; SMN2MAPTPOLBACHE
SCHEMBL9536850 0.90 ACHE (0.37) L3MBTL1SMN1; SMN2MAPTPOLBACHE
SCHEMBL10400743 0.89 SMN1; SMN2 (0.39) L3MBTL1SMN1; SMN2MAPTPOLBACHE
SCHEMBL9540194 0.89 POLB (0.38) L3MBTL1SMN1; SMN2MAPTPOLBACHE
SCHEMBL10401002 0.88 KMT2A (0.36) L3MBTL1SMN1; SMN2MAPTPOLBACHE
SCHEMBL10400945 0.87 MAPT (0.35) L3MBTL1SMN1; SMN2MAPTPOLBACHE
SCHEMBL10401010 0.82 SMN1; SMN2 (0.38) L3MBTL1SMN1; SMN2MAPTPOLBTP53
SCHEMBL10517367 0.80 TP53 (0.39) L3MBTL1SMN1; SMN2MAPTPOLBACHE
SCHEMBL10400778 0.79 SMN1; SMN2 (0.40) L3MBTL1SMN1; SMN2MAPTPOLBACHE

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-4973690-A PYRIMIDIN-2-YL UREAS, HERBICICES, PLANT GROWTH REGULATORS CIBA-GEIGY CORPORATION (US) 1990-11-27 US disclosed