SCHEMBL28824929

SCHEMBL28824929

Cc1cc(F)cc(Nc2ncc(Nc3ccc(F)cc3F)cc2C(N)=O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 4/20 0.45
SYK P43405 5/20 0.45
LMNA P02545 1/20 0.44
DHODH Q02127 2/20 0.42
MAPT P10636 3/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
TP53 P04637 1/20 0.41
TYK2 P29597 1/20 0.39
ZAP70 P43403 1/20 0.39
KCNH2 Q12809 1/20 0.39
AURKB Q96GD4 1/20 0.39
MAP2K2 P36507 1/20 0.39
MAP2K1 Q02750 1/20 0.39
NPC1 O15118 1/20 0.39
AHR P35869 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL28824937 0.90 AKR1C3 (0.46) CSF1RSYKDHODHMAPTTP53
SCHEMBL28824923 0.89 HDAC3 (0.48) CSF1RSYKLMNAMAPTHDAC3
SCHEMBL28824917 0.86 LMNA (0.43) CSF1RSYKLMNADHODHMAPT
SCHEMBL29898289 0.86 LMNA (0.43) CSF1RSYKLMNADHODHMAPT
SCHEMBL28824948 0.84 LMNA (0.48) CSF1RSYKLMNADHODHMAPT
SCHEMBL29898301 0.84 LMNA (0.48) CSF1RSYKLMNADHODHMAPT
SCHEMBL28824930 0.84 SMN1; SMN2 (0.48) CSF1RSYKLMNADHODHMAPT
SCHEMBL29898299 0.84 AKR1C3 (0.46) CSF1RSYKDHODHMAPTTP53
SCHEMBL29898255 0.83 MAPT (0.45) CSF1RSYKLMNAMAPTHDAC3
SCHEMBL28824931 0.83 MAPT (0.45) CSF1RSYKLMNAMAPTHDAC3

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