SCHEMBL8994380

SCHEMBL8994380

N#Cc1c(Br)c(C(F)(F)F)n(CC2(C(=O)O)CCCCC2)c1-c1ccc(Cl)cc1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
GRIA2 P42262 1/20 0.33
GRIA4 P48058 1/20 0.33
ERAP1 Q9NZ08 1/20 0.33
CNR1 P21554 2/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GLA P06280 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
CRHBP P24387 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
CRHR2 Q13324 1/20 0.31
CUL4A Q13619 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL8994487 0.95 POLB (0.36) POLBMAPTGRIA2GRIA4CNR1
SCHEMBL8994400 0.87 POLB (0.36) POLBMAPTGRIA2GRIA4CNR1
SCHEMBL8994385 0.85 POLB (0.37) POLBMAPTGRIA2GRIA4CNR1
SCHEMBL9036502 0.83 PPARG (0.33) POLBMAPTGRIA2GRIA4
SCHEMBL8994415 0.78 ALOX5AP (0.33) GRIA2GRIA4MEN1KMT2A
SCHEMBL8994468 0.77 RXFP1 (0.35) POLBMAPTGRIA2GRIA4KDM4E
SCHEMBL7508068 0.77 KDM4E (0.37) POLBMAPTGRIA2GRIA4CNR1
SCHEMBL7499361 0.77 KDM4E (0.37) POLBMAPTGRIA2GRIA4CNR1
SCHEMBL9057679 0.76 HTT (0.36) POLBMAPTGRIA2GRIA4CNR1
SCHEMBL8994395 0.76 ALDH1A1 (0.33) POLBMAPTCNR1MEN1ALDH1A1

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-0594941-B1 N-substituted carbonyoxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-08-14 EP claimed