SCHEMBL30006817

SCHEMBL30006817

Nc1cccc(-c2ccc3ncc(-c4ccccc4)n3c2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.56
CHEK1 O14757 4/20 0.52
KDR P35968 3/20 0.50
PIK3CA P42336 2/20 0.50
MKNK1 Q9BUB5 1/20 0.50
MKNK2 Q9HBH9 1/20 0.50
DYRK3 O43781 1/20 0.49
CCNT1 O60563 1/20 0.49
CCNA2 P20248 1/20 0.49
CDK2 P24941 1/20 0.49
CDK9 P50750 1/20 0.49
CDK5 Q00535 1/20 0.49
DYRK1A Q13627 1/20 0.49
CDK5R1 Q15078 1/20 0.49
DYRK2 Q92630 1/20 0.49
DYRK1B Q9Y463 1/20 0.49
GSK3B P49841 1/20 0.48
PRMT5 O14744 1/20 0.47
WDR77 Q9BQA1 1/20 0.47
MAOA P21397 1/20 0.47

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
SCHEMBL23535558 1.00 KCNH2 (0.56) KCNH2CHEK1KDRPIK3CAMKNK1
SCHEMBL26179021 0.86 CHEK1 (0.50) KCNH2CHEK1KDRPIK3CAMKNK1
SCHEMBL26178954 0.85 FLT3 (0.53) KCNH2CHEK1KDRMKNK1MKNK2
SCHEMBL15287989 0.85 KDR (0.57) KCNH2CHEK1KDRPIK3CAMKNK1
SCHEMBL30217979 0.82 CHEK1 (0.51) KCNH2CHEK1KDRPIK3CAMKNK1
SCHEMBL30006563 0.81 TGFBR1 (0.50) KCNH2CHEK1MKNK1MKNK2DYRK3
SCHEMBL23535570 0.81 TGFBR1 (0.50) KCNH2CHEK1MKNK1MKNK2DYRK3
SCHEMBL73445 0.78 MIF (0.60) CHEK1KDRPIK3CADYRK3CCNT1
SCHEMBL23535590 0.77 KCNH2 (0.51) KCNH2KDRPIK3CAMKNK1MKNK2
SCHEMBL13336369 0.77 KDR (0.75) KDRDYRK3CCNT1CCNA2CDK2

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
CN-120025336-A LIN28 inhibitors and methods of use thereof 加利福尼亚大学董事会 2025-05-23 CN disclosed
CN-115087657-B LIN28 inhibitors and methods of use thereof 加利福尼亚大学董事会 2025-01-21 CN disclosed