SCHEMBL31333839

SCHEMBL31333839

O=C1OCCN1c1cccc(-c2nc(N[C@H]3CC[C@H](C(=O)O)CC3)ncc2F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 8/20 0.42
CDK2 P24941 3/20 0.40
CCNA2 P20248 1/20 0.40
MAPK3 P27361 1/20 0.40
IDH1 O75874 1/20 0.38
CDK1 P06493 2/20 0.38
CCNB2 O95067 1/20 0.38
CCNE2 O96020 1/20 0.38
CCNB1 P14635 1/20 0.38
CCNE1 P24864 1/20 0.38
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38
CCNB3 Q8WWL7 1/20 0.38
PSEN1 P49768 2/20 0.37
PSEN2 P49810 2/20 0.37
APH1B Q8WW43 2/20 0.37
NCSTN Q92542 2/20 0.37
APH1A Q96BI3 2/20 0.37
PSENEN Q9NZ42 2/20 0.37
CAMK1D Q8IU85 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
SCHEMBL31333597 0.95 MAPK1 (0.41) MAPK1CDK2CCNA2MAPK3CDK1
SCHEMBL31334703 0.92 MAPK1 (0.42) MAPK1CDK2CCNA2MAPK3IDH1
SCHEMBL31333553 0.91 MAPK1 (0.42) MAPK1CDK2CCNA2MAPK3IDH1
SCHEMBL31333841 0.89 MAP4K1 (0.44) MAPK1CDK2CCNA2MAPK3
SCHEMBL31334173 0.89 MAPK1 (0.42) MAPK1CDK2CCNA2MAPK3IDH1
SCHEMBL31334329 0.89 CDK9 (0.42) MAPK1CDK2CCNA2MAPK3IDH1
SCHEMBL31334455 0.89 CDK9 (0.42) MAPK1CDK2CCNA2MAPK3IDH1
SCHEMBL31334975 0.88 MAPK1 (0.41) MAPK1CDK2CCNA2MAPK3CDK1
SCHEMBL31334417 0.88 MAPK1 (0.41) MAPK1CDK2CCNA2MAPK3CDK1
SCHEMBL31334897 0.87 CDK6 (0.42) MAPK1CDK2CCNA2MAPK3IDH1

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