SCHEMBL8994475

SCHEMBL8994475

CC1(C(=O)O)CC1n1c(Cl)c(C#N)c(Br)c1-c1ccc(Cl)c(Cl)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
SLC6A3 Q01959 7/20 0.32
SLC6A2 P23975 4/20 0.32
MAPK14 Q16539 1/20 0.32
EGFR P00533 2/20 0.32
S1PR1 P21453 1/20 0.32
S1PR5 Q9H228 1/20 0.32
MET P08581 1/20 0.32
KDR P35968 1/20 0.32
SRC P12931 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CCR2 P41597 2/20 0.31
HTT P42858 1/20 0.31
APP P05067 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
SCHEMBL8994474 0.72 CCR2 (0.35) MEN1POLBKMT2ASLC6A3MAPK14
SCHEMBL8994492 0.71 MAPK14 (0.46) MEN1KMT2AMAPK14ALDH1A1LMNA
SCHEMBL8994404 0.71
SCHEMBL8994490 0.70 MAPK14 (0.42) MEN1KMT2AMAPK14METKDR
SCHEMBL9058962 0.69 P2RX3 (0.37) MEN1POLBKMT2AMAPK14MET
SCHEMBL8994485 0.67 KDM4E (0.38) MEN1KMT2ASLC6A3MAPK14S1PR1
SCHEMBL9216319 0.65 MAP3K14 (0.39) MEN1POLBKMT2AMAPK14EGFR
SCHEMBL7501169 0.65 NPC1 (0.38) POLBS1PR1S1PR5METKDR
SCHEMBL9019133 0.64 MAPK14 (0.41) POLBMAPK14METKDRLMNA
SCHEMBL9019167 0.64 MAPK14 (0.40) MEN1POLBKMT2AMAPK14MET

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