SCHEMBL30907259

SCHEMBL30907259

CCC(=O)c1cc(C)c(-c2cc3cnc(Cl)cc3nc2C(=O)N2CCC2)cn1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 8/20 0.35
PDE4D Q08499 7/20 0.35
PDE4A P27815 4/20 0.35
PDE4C Q08493 4/20 0.35
RAB9A P51151 3/20 0.33
NPC1 O15118 2/20 0.33
DPP4 P27487 1/20 0.32
DPP8 Q6V1X1 1/20 0.32
ABL1 P00519 1/20 0.32
PIK3C3 Q8NEB9 2/20 0.32
CCNK O75909 2/20 0.31
CCNA2 P20248 2/20 0.31
CDK2 P24941 2/20 0.31
CDK7 P50613 2/20 0.31
CCNH P51946 2/20 0.31
MNAT1 P51948 2/20 0.31
CDK12 Q9NYV4 2/20 0.31
GRIN2B Q13224 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL30907434 0.92 HTR2C (0.37) RAB9ANPC1ABL1TP53HPGD
SCHEMBL30907166 0.85 ABL1 (0.34) ABL1MEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL30907611 0.82 ABL1 (0.43) ABL1
SCHEMBL30907412 0.82 GPBAR1 (0.32) ABL1
SCHEMBL30907430 0.82 ABL1 (0.34) ABL1KDM4EALDH1A1
SCHEMBL30907485 0.80 MTOR (0.39) RAB9ANPC1ABL1CDK2KDM4E
SCHEMBL30907369 0.80 ABL1 (0.33) ABL1
SCHEMBL30907424 0.75 ABL1 (0.42) ABL1
SCHEMBL30907125 0.75 ABL1 (0.42) ABL1
SCHEMBL30907507 0.72 PDE4B (0.38) PDE4BPDE4DPDE4APDE4CABL1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024097953-A1 NAPHTHYRIDINE COMPOUNDS FOR INHIBITION OF RAF KINASES ENLIVEN INC. (US) 2024-05-10 WO disclosed