SCHEMBL9738366

SCHEMBL9738366

Cc1cc(C(F)(F)F)nc(N(C(N)=O)c2c(C)cccc2OC(F)F)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.39
HCRTR2 O43614 1/20 0.39
MAPT P10636 4/20 0.35
ALDH1A1 P00352 4/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
HPGD P15428 1/20 0.35
TTR P02766 1/20 0.35
HTT P42858 3/20 0.34
ATM Q13315 2/20 0.34
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SYK P43405 3/20 0.34
EPAS1 Q99814 1/20 0.34
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL9739131 0.86 HCRTR1 (0.42) HCRTR1HCRTR2MAPTALDH1A1MEN1
SCHEMBL9739376 0.83 RBP4 (0.39) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL9740354 0.82 MAPK14 (0.39) HCRTR1HCRTR2MAPTALDH1A1MEN1
SCHEMBL9738659 0.80 HPGD (0.38) HCRTR1HCRTR2MAPTALDH1A1MEN1
SCHEMBL10400781 0.79 SMN1; SMN2 (0.36) HCRTR1HCRTR2MAPTALDH1A1MEN1
SCHEMBL9737076 0.78 MAPK14 (0.43) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL9737104 0.74 LMNA (0.40) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL9738360 0.74 MAPK14 (0.41) LMNAHSP90AA1HSP90AB1
SCHEMBL9739327 0.73 SDHB (0.39) ALDH1A1HPGDLMNAKDM4EHSD17B10
SCHEMBL9737393 0.71 ALDH1A1 (0.43) MAPTALDH1A1MEN1KMT2AHPGD

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
US-5159078-A Herbicides, plant growth regulator CIBA-GEIGY CORPORATION (US) 1992-10-27 US disclosed
US-4966622-A HERBICIDES, PLANT GROWTH REGULATORS CIBA-GEIGY CORPORATION (US) 1990-10-30 US disclosed