SCHEMBL9739376

SCHEMBL9739376

Cc1cc(C(F)(F)F)nc(N(C(N)=O)c2c(C)cccc2C(F)(F)F)n1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 6/20 0.39
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.39
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36
CD38 P28907 3/20 0.36
CYP3A4 P08684 2/20 0.36
TTR P02766 1/20 0.35
KCNH2 Q12809 1/20 0.35
SORT1 Q99523 1/20 0.34
PHGDH O43175 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
SCHEMBL9737104 0.89 LMNA (0.40) RBP4ALDH1A1TSHRHSP90AA1HSP90AB1
SCHEMBL9740354 0.87 MAPK14 (0.39) ALDH1A1HSP90AA1HSP90AB1MAPTMEN1
SCHEMBL9737393 0.83 ALDH1A1 (0.43) RBP4ALDH1A1TSHRHSP90AA1HSP90AB1
SCHEMBL9737076 0.83 MAPK14 (0.43) ALDH1A1HSP90AA1HSP90AB1MAPTMEN1
SCHEMBL9738366 0.83 HCRTR1 (0.39) ALDH1A1HSP90AA1HSP90AB1MAPTMEN1
SCHEMBL9738360 0.80 MAPK14 (0.41) HSP90AA1HSP90AB1CD38
SCHEMBL9739960 0.76 HSP90AA1 (0.39) ALDH1A1TSHRHSP90AA1HSP90AB1MAPT
SCHEMBL9738307 0.76 LMNA (0.37) ALDH1A1HSP90AA1HSP90AB1MAPTMEN1
SCHEMBL9739327 0.76 SDHB (0.39) RBP4ALDH1A1HPGDCD38CYP3A4
SCHEMBL9738838 0.75 HSP90AA1 (0.38) RBP4ALDH1A1TSHRHSP90AA1HSP90AB1

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