SCHEMBL24867486

SCHEMBL24867486

CC(C)Cc1ccc(Nc2ncc(C(=O)c3ccncc3)cn2)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.44
VNN1 O95497 8/20 0.43
MAPK1 P28482 1/20 0.42
HDAC3 O15379 2/20 0.42
HDAC1 Q13547 2/20 0.42
HDAC2 Q92769 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42
ACACB O00763 3/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 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
SCHEMBL24867202 0.88 VNN1 (0.50) RAB9AVNN1MAPK1
SCHEMBL24867208 0.86 HDAC3 (0.41) RAB9AVNN1MAPK1HDAC3HDAC1
SCHEMBL24867487 0.86 HDAC3 (0.49) RAB9AVNN1MAPK1HDAC3HDAC1
SCHEMBL24866886 0.86 HDAC3 (0.41) RAB9AVNN1MAPK1HDAC3HDAC1
SCHEMBL24867174 0.85 GAA (0.49) RAB9AMAPK1ACACBKMT2A
SCHEMBL24867491 0.85 GRM5 (0.43) RAB9AMEN1KMT2A
SCHEMBL24867190 0.85 RAB9A (0.47) RAB9AMAPK1HDAC3HDAC1HDAC2
SCHEMBL24866928 0.85 VNN1 (0.46) RAB9AVNN1MAPK1HDAC3HDAC1
SCHEMBL24866925 0.85 VNN1 (0.46) RAB9AVNN1MAPK1HDAC3HDAC1
SCHEMBL31159450 0.83 RORC (0.48) RAB9AMAPK1HDAC3HDAC1HDAC2

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