SCHEMBL24867239

SCHEMBL24867239

COc1cc(CC(C)C)ccc1Nc1ncc(Nc2ccncc2)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.37
BRAF P15056 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GLA P06280 1/20 0.37
TP53 P04637 1/20 0.37
FOS P01100 1/20 0.36
TTR P02766 1/20 0.36
JUN P05412 1/20 0.36
NR3C1 P04150 1/20 0.36
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
AKT1 P31749 1/20 0.36
TTK P33981 3/20 0.36
ALK Q9UM73 1/20 0.36
CCNA2 P20248 1/20 0.36

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
SCHEMBL24867185 0.83 VNN1 (0.43) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL24867147 0.82 POLB (0.36) LMNATP53ALKCDK2PTK2
SCHEMBL24867187 0.81 ACACB (0.38) MAPTALDH1A1LMNABRAFTP53
SCHEMBL24867214 0.80 RAB9A (0.43) MAPTSMN1; SMN2LMNABRAFAKT1
SCHEMBL24866909 0.77 AKT1 (0.42) AKT1
SCHEMBL24866871 0.74 MAPK3 (0.36) SMN1; SMN2ALDH1A1KDM4ECCNA2CDK2
SCHEMBL24866908 0.74 CDK2 (0.42) SMN1; SMN2KDM4ECCNA2CDK2PTK2
SCHEMBL24867232 0.74 AKT1 (0.37) AKT1CCNA2CDK2
SCHEMBL19805995 0.70 FOS (0.47) MAPTALDH1A1FOSTTRJUN
SCHEMBL24867148 0.70 RAB9A (0.40) MAPTSMN1; SMN2LMNACCNA2CDK2

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