SCHEMBL18023940

SCHEMBL18023940

O=C(Nc1c(Br)cc(C(O)(c2cccc(Cl)c2)C(F)(F)F)cc1Br)c1cccc(NC(=O)c2cccnc2Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
RXFP1 Q9HBX9 4/20 0.47
GFER P55789 1/20 0.44
ALDH1A1 P00352 1/20 0.43
CES1 P23141 1/20 0.43
CSF1R P07333 2/20 0.43
RHOC P08134 1/20 0.43
RHOA P61586 1/20 0.43
PTGES O14684 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
BRAF P15056 1/20 0.41
AURKA O14965 1/20 0.41
PPARG P37231 2/20 0.40
PPARD Q03181 2/20 0.40
NR1H4 Q96RI1 2/20 0.40
PPARA Q07869 1/20 0.40

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
SCHEMBL18023941 0.93 MEN1 (0.53) MEN1KMT2ARXFP1GFERALDH1A1
SCHEMBL18023938 0.91 MEN1 (0.57) MEN1KMT2ARXFP1GFERALDH1A1
SCHEMBL18023982 0.90 MEN1 (0.56) MEN1KMT2ARXFP1GFERALDH1A1
SCHEMBL1829876 0.88 MEN1 (0.54) MEN1KMT2ARXFP1GFERALDH1A1
SCHEMBL18023939 0.86 MEN1 (0.53) MEN1KMT2ARXFP1GFERALDH1A1
SCHEMBL18023983 0.85 MEN1 (0.52) MEN1KMT2ARXFP1GFERALDH1A1
SCHEMBL1767081 0.84 MEN1 (0.53) MEN1KMT2ARXFP1GFERALDH1A1
SCHEMBL1829076 0.83 MEN1 (0.52) MEN1KMT2ARXFP1ALDH1A1CSF1R
SCHEMBL1766654 0.81 MEN1 (0.51) MEN1KMT2ARXFP1ALDH1A1CES1
SCHEMBL1812890 0.81 MEN1 (0.48) MEN1KMT2ARXFP1ALDH1A1CSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2531484-B1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-08-17 EP disclosed