SCHEMBL31334142

SCHEMBL31334142

O=C1CCC(Nc2ccc(C3CCN([C@H]4CC[C@H](NC(=O)[C@H]5CC[C@H](Nc6ncc(F)c(-c7cccc(N8CCOCC8=O)c7)n6)CC5)CC4)CC3)c(F)c2)C(=O)N1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 3/20 0.34
CDK2 P24941 3/20 0.34
CDK9 P50750 3/20 0.34
CCNT1 O60563 2/20 0.34
MAPK1 P28482 4/20 0.34
MAP4K1 Q92918 4/20 0.33
KDR P35968 1/20 0.33
CSF1R P07333 6/20 0.33
CDK4 P11802 6/20 0.33
CDK6 Q00534 6/20 0.33
PIK3CD O00329 3/20 0.33
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
JAK3 P52333 1/20 0.32
PTGS2 P35354 1/20 0.32
CCNK O75909 1/20 0.32
CDK7 P50613 1/20 0.32
CCNH P51946 1/20 0.32
CDK5 Q00535 1/20 0.32
CDK5R1 Q15078 1/20 0.32

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
SCHEMBL31334699 1.00 CCNA2 (0.34) CCNA2CDK2CDK9CCNT1MAPK1
SCHEMBL31334834 0.93 CSF1R (0.35) CCNA2CDK2CDK9CCNT1MAPK1
SCHEMBL31334658 0.93 JAK2 (0.37) CCNA2CDK2CDK9CCNT1MAPK1
SCHEMBL31333972 0.93 JAK2 (0.37) CCNA2CDK2CDK9CCNT1MAPK1
SCHEMBL31334643 0.92 BTK (0.35) CCNA2CDK2CDK9CCNT1MAPK1
SCHEMBL31333256 0.92 BTK (0.35) CCNA2CDK2CDK9CCNT1MAPK1
SCHEMBL31334331 0.92 SYK (0.36) CCNA2CDK2CDK9CCNT1MAPK1
SCHEMBL31334917 0.92 SYK (0.36) CCNA2CDK2CDK9CCNT1MAPK1
SCHEMBL31334833 0.92 SYK (0.36) CCNA2CDK2CDK9CCNT1MAPK1
SCHEMBL31335116 0.92 SYK (0.36) CCNA2CDK2CDK9CCNT1MAPK1

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