SCHEMBL21449944

SCHEMBL21449944

Nc1ccc(NC(=O)c2cc(NC(=O)C3[C@H](c4ccc(F)c(C(F)(F)F)c4)C3(Cl)Cl)ccc2Cl)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
LMNA P02545 2/20 0.40
KDM4E B2RXH2 1/20 0.37
GRM4 Q14833 3/20 0.36
ALDH1A1 P00352 1/20 0.36
RECQL P46063 1/20 0.36
TMPRSS4 Q9NRS4 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.36
BTK Q06187 1/20 0.35
KDR P35968 1/20 0.34
RORC P51449 1/20 0.34
JAK2 O60674 1/20 0.34
CSF1R P07333 1/20 0.34
PDGFRB P09619 1/20 0.34
FGFR1 P11362 1/20 0.34
CYP2C9 P11712 1/20 0.34
BRAF P15056 1/20 0.34

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
SCHEMBL21450001 1.00 MEN1 (0.40) MEN1KMT2ALMNAKDM4EGRM4
SCHEMBL29995395 1.00 MEN1 (0.40) MEN1KMT2ALMNAKDM4EGRM4
SCHEMBL18147042 0.92 MEN1 (0.45) MEN1KMT2ALMNAKDM4EGRM4
SCHEMBL18147038 0.92 MEN1 (0.45) MEN1KMT2ALMNAKDM4EGRM4
SCHEMBL20051670 0.90 MEN1 (0.40) MEN1KMT2ALMNAKDM4EGRM4
SCHEMBL22898701 0.90 KMT2A (0.40) MEN1KMT2ALMNAKDM4EGRM4
SCHEMBL20050897 0.90 KMT2A (0.40) MEN1KMT2ALMNAKDM4EGRM4
SCHEMBL18146714 0.90 KMT2A (0.40) MEN1KMT2ALMNAKDM4EGRM4
SCHEMBL18146712 0.90 KMT2A (0.40) MEN1KMT2ALMNAKDM4EGRM4
SCHEMBL29995163 0.90 KMT2A (0.40) MEN1KMT2ALMNAKDM4EGRM4

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
WO-2019194982-A1 MOLECULES HAVING PESTICIDAL UTILITY, COMPOSITIONS AND PEST CONTROLLING PROCESS RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-10-10 WO disclosed