SCHEMBL28824948

SCHEMBL28824948

Cc1cc(F)cc(Nc2ncc(Nc3ccccc3)cc2C(N)=O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
NPC1 O15118 1/20 0.45
MAPT P10636 1/20 0.45
AHR P35869 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SYK P43405 9/20 0.45
TYK2 P29597 1/20 0.44
CSF1R P07333 2/20 0.44
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
MAPK8 P45983 2/20 0.41
MAPK9 P45984 1/20 0.41
AURKB Q96GD4 3/20 0.41
DHODH Q02127 1/20 0.41
AURKA O14965 1/20 0.41
JAK2 O60674 1/20 0.41
ZAP70 P43403 1/20 0.41

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
SCHEMBL29898301 1.00 LMNA (0.48) LMNANPC1MAPTAHRRAB9A
SCHEMBL28824923 0.93 HDAC3 (0.48) LMNANPC1MAPTAHRRAB9A
SCHEMBL29898302 0.91 KDR (0.49) LMNANPC1MAPTAHRRAB9A
SCHEMBL28824932 0.91 KDR (0.49) LMNANPC1MAPTAHRRAB9A
SCHEMBL28824917 0.88 LMNA (0.43) LMNANPC1MAPTAHRRAB9A
SCHEMBL29898289 0.88 LMNA (0.43) LMNANPC1MAPTAHRRAB9A
SCHEMBL29898300 0.87 SYK (0.44) LMNANPC1MAPTAHRRAB9A
SCHEMBL28949528 0.87 SYK (0.44) LMNANPC1MAPTAHRRAB9A
SCHEMBL29898313 0.87 MAPT (0.46) NPC1MAPTAHRRAB9ASMN1; SMN2
SCHEMBL29898255 0.87 MAPT (0.45) LMNANPC1MAPTAHRRAB9A

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-114989079-B RIPK1 kinase target inhibitor and medical application thereof 中国药科大学 2023-06-23 CN disclosed
CN-114989079-A RIPK1 kinase target inhibitor and medical application thereof 中国药科大学 2022-09-02 CN disclosed