SCHEMBL24867487

SCHEMBL24867487

Cc1cc(C(=O)c2cnc(Nc3ccc(CC(C)C)cc3)nc2)ccn1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 3/20 0.49
HDAC1 Q13547 3/20 0.49
HDAC2 Q92769 3/20 0.49
HDAC6 Q9UBN7 3/20 0.49
VNN1 O95497 11/20 0.41
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.38
BRAF P15056 1/20 0.38
PORCN Q9H237 1/20 0.37
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL24867486 0.86 RAB9A (0.44) HDAC3HDAC1HDAC2HDAC6VNN1
SCHEMBL24866946 0.86 HDAC3 (0.41) HDAC3HDAC1HDAC2HDAC6VNN1
SCHEMBL24867202 0.81 VNN1 (0.50) VNN1MAPK1RAB9ASMN1; SMN2
SCHEMBL24866862 0.80 HDAC3 (0.48) HDAC3HDAC1HDAC2HDAC6MAPK1
SCHEMBL24866886 0.80 HDAC3 (0.41) HDAC3HDAC1HDAC2HDAC6VNN1
SCHEMBL24867208 0.80 HDAC3 (0.41) HDAC3HDAC1HDAC2HDAC6VNN1
SCHEMBL31159450 0.79 RORC (0.48) HDAC3HDAC1HDAC2HDAC6MAPK1
SCHEMBL24867203 0.79 MAPK1 (0.44) HDAC3HDAC1HDAC2HDAC6VNN1
SCHEMBL24866925 0.76 VNN1 (0.46) HDAC3HDAC1HDAC2HDAC6VNN1
SCHEMBL24866928 0.76 VNN1 (0.46) HDAC3HDAC1HDAC2HDAC6VNN1

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