SCHEMBL8994397

SCHEMBL8994397

N#Cc1c(Br)c(Br)n(COC(=O)C2CC2)c1Br

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
PAX8 Q06710 1/20 0.33
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL9123097 0.79 ALDH1A1 (0.32) KDM4EALDH1A1MAPK1
SCHEMBL9472193 0.70 HPGD (0.35) KDM4EALDH1A1
SCHEMBL8994464 0.69 L3MBTL1 (0.34) KDM4EMEN1ALDH1A1LMNAKMT2A
SCHEMBL8872033 0.68 KDM4E (0.53) KDM4EMEN1ALDH1A1LMNAKMT2A
SCHEMBL9121110 0.67 KDM4E (0.33) KDM4EALDH1A1
Acetic Acid SCHEMBL9244244 0.66 GAA (0.33) MEN1ALDH1A1LMNAKMT2ATSHR
SCHEMBL9119498 0.66
SCHEMBL9471857 0.66 ALDH1A1 (0.34) KDM4EALDH1A1MAPTTSHRMAPK1
SCHEMBL8994399 0.65
SCHEMBL9120983 0.64 L3MBTL1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0594941-B1 N-substituted carbonyoxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-08-14 EP claimed
EP-0594941-A1 N-substituted carbonyoxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID COMPANY (US) 1994-05-04 EP claimed
US-5232980-A Insecticides, miticides, molluscicides AMERICAN CYANAMID COMPANY (US) 1993-08-03 US claimed
EP-0594941-B1 N-substituted carbonyoxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-08-14 EP disclosed
EP-0594941-A1 N-substituted carbonyoxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID COMPANY (US) 1994-05-04 EP disclosed
US-5232980-A Insecticides, miticides, molluscicides AMERICAN CYANAMID COMPANY (US) 1993-08-03 US disclosed