SCHEMBL9567337

SCHEMBL9567337

N#Cc1c(-c2ccc(C(F)(F)F)cc2)[nH]c(C(F)(F)C(F)(F)F)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.41
ALDH1A1 P00352 4/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 3/20 0.36
GAA P10253 3/20 0.36
HTT P42858 3/20 0.36
LMNA P02545 2/20 0.36
GLA P06280 2/20 0.36
HPGD P15428 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
DAO P14920 1/20 0.35
ADORA1 P30542 1/20 0.34
BIRC5 O15392 2/20 0.33
DHODH Q02127 2/20 0.33
DYRK1A Q13627 1/20 0.33

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
SCHEMBL9567308 0.83 KIF11 (0.41) KIF11ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL9567377 0.83 ADORA1 (0.37) ALDH1A1MAPTSMN1; SMN2TDP1KDM4E
SCHEMBL1180416 0.82 KIF11 (0.46) KIF11ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL9567335 0.82 ALDH1A1 (0.42) ALDH1A1MAPTSMN1; SMN2KDM4EGAA
SCHEMBL1180132 0.80 ALDH1A1 (0.48) ALDH1A1MAPTSMN1; SMN2KDM4EGAA
SCHEMBL10591516 0.75 KIF11 (0.45) KIF11ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL9567399 0.75 ALDH1A1 (0.41) ALDH1A1MAPTSMN1; SMN2TDP1KDM4E
SCHEMBL9389357 0.75 KIF11 (0.35) KIF11ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL8976164 0.73 IDO1 (0.40) ALDH1A1MAPTKDM4EGAAHTT
SCHEMBL9224576 0.72 ALDH1A1 (0.49) ALDH1A1MAPTSMN1; SMN2KDM4EGAA

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
EP-0530147-A1 3-Cyano-2-phenyl-pyrroles as pesticides CIBA-GEIGY AG (CH) 1993-03-03 EP claimed
EP-0530147-A1 3-Cyano-2-phenyl-pyrroles as pesticides CIBA-GEIGY AG (CH) 1993-03-03 EP disclosed