SCHEMBL29650587

SCHEMBL29650587

CC(C)Nc1ncnc2cnccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 9/20 0.56
LATS2 Q9NRM7 8/20 0.56
SMN1; SMN2 Q16637 4/20 0.54
LMNA P02545 3/20 0.54
HTT P42858 2/20 0.54
EGFR P00533 2/20 0.52
CD38 P28907 1/20 0.50
GALR3 O60755 1/20 0.45
NR2F2 P24468 1/20 0.45
NPC1 O15118 3/20 0.43
TP53 P04637 3/20 0.43
HPGD P15428 3/20 0.43
RAB9A P51151 3/20 0.43
HSD17B10 Q99714 3/20 0.43
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL31375142 0.84 GALR3 (0.58) LATS1LATS2EGFRGALR3NR2F2
SCHEMBL29650600 0.83 LATS1 (0.61) LATS1LATS2SMN1; SMN2LMNAHTT
SCHEMBL3322882 0.77 EGFR (0.56) LATS1LATS2LMNAHTTEGFR
SCHEMBL15889088 0.77 GALR3 (0.71) SMN1; SMN2LMNAHTTEGFRCD38
SCHEMBL30117681 0.77 GALR3 (0.71) SMN1; SMN2LMNAHTTEGFRCD38
SCHEMBL20547912 0.77 LATS1 (0.61) LATS1LATS2EGFR
SCHEMBL22302812 0.77 LATS1 (0.56) LATS1LATS2SMN1; SMN2LMNAEGFR
SCHEMBL29707469 0.76 LATS1 (0.61) LATS1LATS2EGFR
SCHEMBL10267527 0.75 LATS1 (0.67) LATS1LATS2
SCHEMBL31375768 0.75 EGFR (0.65) LATS1LMNAEGFRCD38NPC1

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
CN-114703144-A 6-6 fused bicyclic heteroaryl compounds and their use as LATS inhibitors 诺华股份有限公司 2022-07-05 CN disclosed