SCHEMBL4352718

SCHEMBL4352718

Cc1nc(C(F)F)c(C(=O)NC2=CI=CCC2c2ccccc2)s1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.40
RECQL P46063 1/20 0.40
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 5/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 4/20 0.32
GAA P10253 3/20 0.32
HTT P42858 4/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
ABCC8 Q09428 1/20 0.31
KCNJ11 Q14654 1/20 0.31
NTRK1 P04629 1/20 0.31
ALDH1A1 P00352 2/20 0.30
KDM4E B2RXH2 1/20 0.30
LMNA P02545 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
SCHEMBL12903702 0.73 HTT (0.51) RAB9ARECQLKMT2ANPC1SMN1; SMN2
SCHEMBL4658459 0.73 KMT2A (0.36) RAB9ARECQLMEN1KMT2ANPC1
SCHEMBL2911307 0.70 RAB9A (0.46) RAB9ARECQLMEN1KMT2ANPC1
SCHEMBL13064249 0.70 TSHR (0.50) RAB9ARECQLMEN1KMT2ANPC1
SCHEMBL13980917 0.69 CNR1 (0.43) RAB9ARECQLMEN1KMT2ANPC1
SCHEMBL13478938 0.68 CNR1 (0.43) RAB9ARECQLMEN1KMT2ANPC1
SCHEMBL3146828 0.68 CNR1 (0.43) RAB9ARECQLMEN1KMT2ANPC1
SCHEMBL4352723 0.66 RAB9A (0.42) RAB9ARECQLMEN1KMT2ANPC1
SCHEMBL13980907 0.66 ALDH1A1 (0.40) RAB9ARECQLNPC1SMN1; SMN2TP53
SCHEMBL13478968 0.66 L3MBTL1 (0.38) RAB9ARECQLMEN1KMT2ANPC1

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-2132989-A2 Agent combinations Bayer CropScience AG (DE) 2009-12-16 EP disclosed