SCHEMBL9737374

SCHEMBL9737374

NC(=O)N(c1nc(-c2ccco2)cc(C(F)(F)F)n1)c1ccccc1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.46
HPGD P15428 5/20 0.46
HSD17B10 Q99714 5/20 0.46
ALDH1A1 P00352 4/20 0.46
TLR8 Q9NR97 4/20 0.46
HTT P42858 3/20 0.46
TP53 P04637 2/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
JAK2 O60674 1/20 0.46
STAT3 P40763 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
TSHR P16473 5/20 0.43
POLB P06746 3/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
ATM Q13315 1/20 0.43

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
SCHEMBL9737730 0.78 TLR8 (0.35) KDM4EHPGDHSD17B10ALDH1A1TLR8
SCHEMBL9739960 0.67 HSP90AA1 (0.39) KDM4EHPGDHSD17B10ALDH1A1HTT
SCHEMBL9737393 0.67 ALDH1A1 (0.43) HPGDALDH1A1MAPTTSHRKMT2A
SCHEMBL9738838 0.66 HSP90AA1 (0.38) HPGDHSD17B10ALDH1A1MAPTL3MBTL1
SCHEMBL17336762 0.66 KDM4E (0.60) KDM4EHPGDHSD17B10ALDH1A1TLR8
SCHEMBL9737486 0.65 HSP90AA1 (0.37) HPGDHSD17B10ALDH1A1TP53MAPT
SCHEMBL9739285 0.65 CYP3A4 (0.39) TP53SMN1; SMN2L3MBTL1TSHRKMT2A
SCHEMBL9739031 0.64 KMT2A (0.39) HPGDHSD17B10ALDH1A1HTTMAPT
SCHEMBL9737398 0.64 GPBAR1 (0.37) KDM4EHPGDHSD17B10ALDH1A1HTT
SCHEMBL9739131 0.63 HCRTR1 (0.42) KDM4EHPGDALDH1A1HTTMAPT

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