SCHEMBL28879230

SCHEMBL28879230

CC(Cc1nc(N)c2ccncc2n1)c1cn(C)c2ncccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.36
▸ KDM6B O15054 1/20 0.36
▸ KDM5A P29375 1/20 0.36
▸ KDM4C Q9H3R0 1/20 0.36
▸ PIK3CD O00329 1/20 0.35
▸ RPS6KA5 O75582 2/20 0.33
▸ DYRK1A Q13627 1/20 0.33
▸ TLR9 Q9NR96 1/20 0.33
▸ TLR8 Q9NR97 1/20 0.33
▸ TLR7 Q9NYK1 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ PDPK1 O15530 1/20 0.32
▸ TGFBR1 P36897 1/20 0.32
▸ IKBKE Q14164 1/20 0.32
▸ TBK1 Q9UHD2 1/20 0.32
▸ HCRTR1 O43613 1/20 0.31
▸ HCRTR2 O43614 1/20 0.31
▸ CLK1 P49759 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ HTR2A P28223 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
SCHEMBL28331426 0.74 LATS1 (0.45) KDM4CRPS6KA5DYRK1ATBK1CLK1
SCHEMBL820570 0.68 DYRK1A (0.47) KDM4EKDM6BKDM5AKDM4CDYRK1A
SCHEMBL24117380 0.67 PDPK1 (0.36) KDM4EKDM6BKDM5AKDM4CDYRK1A
SCHEMBL15077818 0.65 DYRK1A (0.44) KDM4EKDM6BKDM5AKDM4CDYRK1A
SCHEMBL15077824 0.63 DYRK1A (0.43) KDM4EKDM6BKDM5AKDM4CDYRK1A
SCHEMBL5768942 0.63 LATS1 (0.38) KDM4CCLK1LATS1LATS2
SCHEMBL12501163 0.62 IKBKE (0.56) KDM4EKDM6BKDM5AKDM4CDYRK1A
SCHEMBL20574445 0.62 LATS1 (0.68) LATS1LATS2
SCHEMBL250853 0.62 ACHE (0.42) KDM4CRPS6KA5CLK1LATS1LATS2
SCHEMBL15792325 0.62 DYRK1A (0.49) KDM4EKDM6BKDM5AKDM4CDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114621222-A 6-6 fused bicyclic heteroaryl compounds and their use as LATS inhibitors 诺华股份有限公司 2022-06-14 — — CN claimed
CN-110573511-A 6-6 fused bicyclic heteroaryl compounds and their use as LATS inhibitors 诺华股份有限公司 2019-12-13 — — CN claimed
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
CN-114621222-A 6-6 fused bicyclic heteroaryl compounds and their use as LATS inhibitors 诺华股份有限公司 2022-06-14 — — CN disclosed
CN-110573511-A 6-6 fused bicyclic heteroaryl compounds and their use as LATS inhibitors 诺华股份有限公司 2019-12-13 — — CN disclosed
Send feedback