SCHEMBL8773853

SCHEMBL8773853

N#Cc1cc(F)c(O)c(Br)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.72
ALB P02768 2/20 0.72
MEN1 O00255 1/20 0.72
KMT2A Q03164 1/20 0.72
HTT P42858 1/20 0.37
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA2 P00918 2/20 0.33
CA6 P23280 2/20 0.33
EGLN2 Q96KS0 2/20 0.33
EGFR P00533 2/20 0.33
CA1 P00915 1/20 0.33
CA4 P22748 1/20 0.33
CA12 O43570 1/20 0.33
CA3 P07451 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 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
Bromoxynil SCHEMBL1701902 0.84 TTR (1.00) TTRALBMEN1KMT2AHTT
Bromoxynil SCHEMBL19210 0.84 TTR (1.00) TTRALBMEN1KMT2AHTT
SCHEMBL198609 0.84 TTR (0.52) TTRALBMEN1KMT2ACA2
SCHEMBL20906090 0.83 TTR (0.78) TTRALBMEN1KMT2AHTT
SCHEMBL30689086 0.83 TTR (0.78) TTRALBMEN1KMT2AHTT
Bromoxynil SCHEMBL466353 0.82 TTR (0.95) TTRALBMEN1KMT2AHTT
Bromoxynil SCHEMBL29642876 0.82 TTR (0.95) TTRALBMEN1KMT2AHTT
Bromoxynil SCHEMBL726301 0.82 TTR (0.95) TTRALBMEN1KMT2AHTT
Bromoxynil SCHEMBL22721314 0.82 TTR (0.95) TTRALBMEN1KMT2AHTT
SCHEMBL20912550 0.78 TTR (0.52) TTRALBMEN1KMT2AHTT

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122036560-A Radioactive medical isotope18F-labeled norepinephrine analogue as well as preparation method and application thereof 中国医学科学院阜外医院 2026-05-15 CN disclosed
WO-2017012647-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF INFLAMMATORY DISORDERS GALAPAGOS NV (BE) 2017-01-26 WO disclosed
WO-2017012647-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF INFLAMMATORY DISORDERS GALAPAGOS NV (BE) 2017-01-26 WO disclosed
EP-0470669-B1 Preparation of fluorophenols, fluorohalophenols, N-acylfluoroanilines, and N-acylfluorohaloanilines DOWELANCO (US) 1997-11-12 EP disclosed
US-5164502-A Fluorinating agents DOWELANCO (US) 1992-11-17 US disclosed
US-5116982-A Fluorination DOWELANCO (US) 1992-05-26 US disclosed
EP-0470669-A2 Preparation of fluorophenols, fluorohalophenols, N-acylfluoroanilines, and N-acylfluorohaloanilines DOWELANCO (US) 1992-02-12 EP disclosed