SCHEMBL9738322

SCHEMBL9738322

Cc1cc(C(F)(F)F)nc(N(C(N)=O)c2cc(Cl)cc(Cl)c2)n1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
ATF1 P18846 2/20 0.38
NFKB1 P19838 2/20 0.38
ALDH1A1 P00352 7/20 0.36
MAPT P10636 3/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
HPGD P15428 1/20 0.36
POLB P06746 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CDK8 P49336 1/20 0.33
CDK19 Q9BWU1 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPC1 O15118 1/20 0.32
GAA P10253 1/20 0.32
PHGDH O43175 1/20 0.31

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
SCHEMBL9737938 0.81 HSP90AA1 (0.38) HSP90AA1HSP90AB1ALDH1A1MAPTMEN1
SCHEMBL9737076 0.80 MAPK14 (0.43) HSP90AA1HSP90AB1ALDH1A1MAPTMEN1
SCHEMBL9738307 0.77 LMNA (0.37) HSP90AA1HSP90AB1ALDH1A1MAPTMEN1
SCHEMBL9740354 0.77 MAPK14 (0.39) HSP90AA1HSP90AB1ALDH1A1MAPTMEN1
SCHEMBL9737826 0.77 IGF1R (0.44) ALDH1A1MAPTHPGDPOLBHSD17B10
SCHEMBL9738140 0.77 HSP90AA1 (0.38) HSP90AA1HSP90AB1ALDH1A1MAPTMEN1
SCHEMBL9737104 0.76 LMNA (0.40) HSP90AA1HSP90AB1ALDH1A1MAPTMEN1
SCHEMBL9738360 0.76 MAPK14 (0.41) HSP90AA1HSP90AB1POLBNPC1GAA
SCHEMBL9738659 0.76 HPGD (0.38) HSP90AA1HSP90AB1ALDH1A1MAPTMEN1
SCHEMBL9739960 0.75 HSP90AA1 (0.39) HSP90AA1HSP90AB1ALDH1A1MAPTMEN1

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