SCHEMBL31334396

SCHEMBL31334396

O=C1CCC(Nc2ccc(N3CCN([C@H]4CC[C@H](C(=O)NC5CCC(Nc6ncc(Cl)c(-c7cccc(-n8ccccc8=O)c7)n6)CC5)CC4)CC3)c(F)c2)C(=O)N1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.37
CCNA2 P20248 2/20 0.36
CDK2 P24941 2/20 0.36
CCNT1 O60563 1/20 0.36
CCNK O75909 1/20 0.36
CDK7 P50613 1/20 0.36
CDK9 P50750 1/20 0.36
CCNH P51946 1/20 0.36
CDK13 Q14004 1/20 0.36
CDK12 Q9NYV4 1/20 0.36
PAK1 Q13153 1/20 0.35
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPK1 P28482 11/20 0.34
EGFR P00533 1/20 0.33
F10 P00742 1/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
MAPK3 P27361 1/20 0.33

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
SCHEMBL31333777 0.95 MEN1 (0.35) CCNA2CDK2CCNT1CCNKCDK7
SCHEMBL31333358 0.95 MEN1 (0.35) CCNA2CDK2CCNT1CCNKCDK7
SCHEMBL31335037 0.95 MEN1 (0.35) CCNA2CDK2CCNT1CCNKCDK7
SCHEMBL31333382 0.95 MEN1 (0.35) CCNA2CDK2CCNT1CCNKCDK7
SCHEMBL31334044 0.95 MEN1 (0.35) CCNA2CDK2CCNT1CCNKCDK7
SCHEMBL31333963 0.95 MEN1 (0.35) CCNA2CDK2CCNT1CCNKCDK7
SCHEMBL31333887 0.95 MEN1 (0.35) CCNA2CDK2CCNT1CCNKCDK7
SCHEMBL31333350 0.91 CDK4 (0.34) CCNA2CDK2CCNT1CCNKCDK7
SCHEMBL31333329 0.91 CDK4 (0.34) CCNA2CDK2CCNT1CCNKCDK7
SCHEMBL31334478 0.87 MEN1 (0.39) BTKCCNA2CDK2CCNT1CCNK

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
EP-4709720-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN Larkspur Biosciences, Inc. (US) 2026-03-18 EP disclosed
WO-2024233846-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN LARKSPUR BIOSCIENCES, INC. (US) 2024-11-14 WO disclosed