SCHEMBL9217692

SCHEMBL9217692

N#Cc1c(Br)c(C(F)(F)F)n(-c2ccc(Cl)cc2)c1-c1ccc(Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 4/20 0.38
HPGD P15428 3/20 0.38
LMNA P02545 3/20 0.38
MEN1 O00255 2/20 0.38
HTT P42858 2/20 0.38
KMT2A Q03164 2/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
NPSR1 Q6W5P4 3/20 0.38
RXFP1 Q9HBX9 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.35
PTGS1 P23219 4/20 0.33
PTGS2 P35354 4/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL7548622 0.82 KDM4E (0.39) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL8994449 0.82 KDM4E (0.39) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL7508068 0.80 KDM4E (0.37) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL7499361 0.80 KDM4E (0.37) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL9057679 0.79 HTT (0.36) ALDH1A1KDM4EHPGDLMNAMEN1
Chlorfenapyr SCHEMBL27488880 0.78 RXFP1 (0.35) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL9211327 0.78 MAPT (0.39) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL9423599 0.77 KDM4E (0.38) ALDH1A1KDM4EHPGDLMNAMEN1
Chlorfenapyr SCHEMBL40337 0.77 RXFP1 (0.35) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL27916628 0.77 KDM4E (0.33) ALDH1A1KDM4EHPGDLMNAMEN1

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-0484614-B1 N-acylated arylpyrroles useful as insecticidal, acaricidal, nematicidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1995-05-24 EP claimed