SCHEMBL9422643

SCHEMBL9422643

N#Cc1c(Cl)c(C(F)(F)F)n(CN(CC(=O)O)C(=O)c2ccc(Cl)cc2)c1-c1ccc(Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
NPC1 O15118 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAPT P10636 3/20 0.37
POLB P06746 2/20 0.37
GPBAR1 Q8TDU6 1/20 0.34
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
CTSL P07711 1/20 0.32
CTSS P25774 1/20 0.32
GRIA2 P42262 1/20 0.32
GRIA4 P48058 1/20 0.32
HPGD P15428 3/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 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
SCHEMBL9017304 0.96 POLB (0.36) ALDH1A1NPC1L3MBTL1MAPTPOLB
SCHEMBL9017388 0.89 POLB (0.37) ALDH1A1L3MBTL1MAPTPOLBMEN1
SCHEMBL9017291 0.79 DAGLA (0.39) ALDH1A1MAPTPOLBMEN1KMT2A
SCHEMBL7494704 0.75 KDM4E (0.39) ALDH1A1L3MBTL1MAPTPOLBADORA2A
SCHEMBL9460809 0.74 POLB (0.39) ALDH1A1L3MBTL1MAPTPOLBMEN1
SCHEMBL9036743 0.74 KDM4E (0.38) ALDH1A1L3MBTL1MAPTPOLBADORA2A
SCHEMBL8994385 0.73 POLB (0.37) ALDH1A1MAPTPOLBMEN1KMT2A
SCHEMBL9460811 0.73 POLB (0.37) ALDH1A1MAPTPOLBADORA2AADORA1
SCHEMBL8994400 0.72 POLB (0.36) ALDH1A1MAPTPOLBMEN1KMT2A
SCHEMBL9017310 0.72 KMT2A (0.47) ALDH1A1NPC1MAPTPOLBADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6220012-A None JP disclosed
JP-H06220012-A N-AMINOALKYLCARBONYLOXYALKYLPYRROLE INSECTICIDAL, ACARICIDAL AND MOLLUSCICIDAL AGENTS AMERICAN CYANAMID CO 1994-08-09 JP disclosed