SCHEMBL24867289

SCHEMBL24867289

CC(C)Cc1ccc(Nc2ccc(-c3cccnc3)cn2)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR55 Q9Y2T6 5/20 0.50
PCSK9 Q8NBP7 1/20 0.46
RAB9A P51151 1/20 0.44
WNT3A P56704 1/20 0.43
CYP2A6 P11509 2/20 0.42
MKNK1 Q9BUB5 1/20 0.42
MKNK2 Q9HBH9 1/20 0.42
CCNK O75909 2/20 0.41
CDK12 Q9NYV4 2/20 0.41
FLT3 P36888 1/20 0.40
PORCN Q9H237 2/20 0.40
USP1 O94782 1/20 0.40
WDR48 Q8TAF3 1/20 0.40
CYP2D6 P10635 1/20 0.40

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
SCHEMBL24867308 0.88 PRKAA2 (0.42) WNT3APORCN
SCHEMBL24867284 0.87 WNT3A (0.43) RAB9AWNT3AMKNK1
SCHEMBL24867276 0.87 RAB9A (0.46) GPR55PCSK9RAB9ACYP2A6MKNK1
SCHEMBL24867309 0.83 ACACB (0.44) WNT3AFLT3
SCHEMBL12413787 0.82 MKNK1 (0.61) RAB9ACYP2A6MKNK1MKNK2CYP2D6
SCHEMBL24866935 0.80 RAB9A (0.48) RAB9A
SCHEMBL24867283 0.79 AKT1 (0.40) RAB9AMKNK1
SCHEMBL24867310 0.79 PANK3 (0.43)
SCHEMBL24867268 0.74 CHEK1 (0.49) RAB9AWNT3A
SCHEMBL24866885 0.74 RAB9A (0.52) RAB9ACCNKCYP2D6

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
WO-2023283488-A9 CDK19-SELECTIVE INHIBITORS, AND METHODS OF USE THEREOF CZ BIOHUB SF, LLC (US) 2023-05-25 WO disclosed
WO-2023283488-A2 CDK19-SELECTIVE INHIBITORS, AND METHODS OF USE THEREOF CHAN ZUCKERBERG BIOHUB, INC. (US) 2023-01-12 WO disclosed