SCHEMBL8994449

SCHEMBL8994449

[CH2]n1c(-c2ccc(Cl)cc2)c(C#N)c(Br)c1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.39
HPGD P15428 4/20 0.39
LMNA P02545 3/20 0.39
ALDH1A1 P00352 3/20 0.39
HTT P42858 2/20 0.39
MEN1 O00255 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
CRHBP P24387 1/20 0.39
KMT2A Q03164 1/20 0.39
CRHR2 Q13324 1/20 0.39
USP2 O75604 1/20 0.33
THRB P10828 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
POLB P06746 2/20 0.32
MAPT P10636 2/20 0.32
NPSR1 Q6W5P4 3/20 0.31
GRIA2 P42262 1/20 0.31
GRIA4 P48058 1/20 0.31
AR P10275 1/20 0.31

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
SCHEMBL8994459 0.86 KDM4E (0.40) KDM4EHPGDLMNAALDH1A1HTT
SCHEMBL7548622 0.83 KDM4E (0.39) KDM4EHPGDLMNAALDH1A1HTT
SCHEMBL9217692 0.82 ALDH1A1 (0.38) KDM4EHPGDLMNAALDH1A1HTT
SCHEMBL7508068 0.81 KDM4E (0.37) KDM4EHPGDLMNAALDH1A1HTT
SCHEMBL7499361 0.81 KDM4E (0.37) KDM4EHPGDLMNAALDH1A1HTT
SCHEMBL9057679 0.80 HTT (0.36) KDM4EHPGDLMNAALDH1A1HTT
SCHEMBL9211327 0.79 MAPT (0.39) KDM4EHPGDLMNAALDH1A1HTT
SCHEMBL9423599 0.78 KDM4E (0.38) KDM4EHPGDLMNAALDH1A1HTT
SCHEMBL9279148 0.78 POLB (0.34) KDM4EHPGDLMNAALDH1A1HTT
SCHEMBL9218224 0.77 MEN1 (0.37) KDM4EHPGDLMNAALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0594942-B1 N-aminoalkylcarbonyloxyalkylpyrrole insecticidal acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-09-04 EP claimed
EP-0594940-B1 N-oxy- and thioalkylcarbonyloxyalkypyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-08-14 EP claimed
EP-0594941-B1 N-substituted carbonyoxyalkylpyrrole 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