SCHEMBL9037689

SCHEMBL9037689

N#Cc1c(Br)c(C(F)(F)F)n(COC(=O)c2ccco2)c1-c1ccc(Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
KDM4E B2RXH2 5/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 6/20 0.35
POLB P06746 2/20 0.35
GFER P55789 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.33
HPGD P15428 3/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
RXFP1 Q9HBX9 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
SCHEMBL9036640 0.82 HTT (0.36) LMNAKDM4EKMT2AMEN1NPC1
SCHEMBL9215860 0.81 KMT2A (0.42) LMNAKDM4EKMT2AMEN1HSD17B10
SCHEMBL9035868 0.81 ALDH1A1 (0.38) LMNAKDM4EKMT2AMEN1MAPT
SCHEMBL8994464 0.79 L3MBTL1 (0.34) LMNAKDM4EKMT2AMEN1TSHR
SCHEMBL8994468 0.79 RXFP1 (0.35) LMNAKDM4EKMT2AMEN1MAPT
SCHEMBL9036751 0.78 KDM4E (0.39) KDM4EKMT2AMEN1TSHRHSD17B10
SCHEMBL9017343 0.77 KMT2A (0.44) KDM4EKMT2AMEN1NPC1RAB9A
SCHEMBL8994395 0.77 ALDH1A1 (0.33) LMNAKMT2AMEN1TSHRRAB9A
SCHEMBL5819212 0.77 KDM4E (0.34) LMNAKDM4EKMT2AMEN1NPC1
SCHEMBL8994408 0.77 OPRM1 (0.38) LMNAHTTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0594940-B1 N-oxy- and thioalkylcarbonyloxyalkypyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-08-14 EP claimed
EP-0594940-A1 N-oxy- and thioalkylcarbonyloxyalkypyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID COMPANY (US) 1994-05-04 EP claimed
US-5286741-A N-oxy- and thioalkylcarbonyloxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID COMPANY (US) 1994-02-15 US claimed