SCHEMBL29650600

SCHEMBL29650600

C[C@H](Nc1ncnc2cnccc12)C(F)(F)F

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 13/20 0.61
LATS2 Q9NRM7 10/20 0.61
EGFR P00533 3/20 0.47
GALR3 O60755 1/20 0.40
NR2F2 P24468 1/20 0.40
CD38 P28907 1/20 0.40
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
JAK2 O60674 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL29650587 0.83 LATS1 (0.56) LATS1LATS2EGFRGALR3NR2F2
SCHEMBL31375142 0.78 GALR3 (0.58) LATS1LATS2EGFRGALR3NR2F2
SCHEMBL20573808 0.76 LATS1 (1.00) LATS1LATS2
SCHEMBL29650608 0.75 LATS1 (0.60) LATS1LATS2EGFR
SCHEMBL22302812 0.74 LATS1 (0.56) LATS1LATS2EGFRCD38LMNA
SCHEMBL3322882 0.72 EGFR (0.56) LATS1LATS2EGFRLMNAHTT
SCHEMBL31375768 0.69 EGFR (0.65) LATS1EGFRCD38LMNA
SCHEMBL29650589 0.69 EGFR (0.61) LATS1LATS2EGFRLMNAHTT
SCHEMBL6371635 0.68 EGFR (0.42) LATS1LATS2EGFR
SCHEMBL3327457 0.68 EGFR (0.52) LATS1LATS2EGFRLMNASMN1; SMN2

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