SCHEMBL31334897

SCHEMBL31334897

O=C1OCCN1c1cccc(-c2nc(NC3CCNCC3)ncc2F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK6 Q00534 11/20 0.42
CDK4 P11802 9/20 0.42
CSF1R P07333 5/20 0.42
CDK2 P24941 3/20 0.42
CCNA2 P20248 2/20 0.42
CDK5 Q00535 2/20 0.42
CDK5R1 Q15078 2/20 0.42
CCNK O75909 1/20 0.42
CDK7 P50613 1/20 0.42
CDK9 P50750 1/20 0.42
CCNH P51946 1/20 0.42
CCND1 P24385 3/20 0.41
CCND3 P30281 1/20 0.41
MAPK1 P28482 4/20 0.40
MAPK3 P27361 1/20 0.40
IDH1 O75874 1/20 0.40
MAPK8 P45983 2/20 0.39
CCNB2 O95067 1/20 0.39
CCNE2 O96020 1/20 0.39
CDK1 P06493 1/20 0.39

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
SCHEMBL31334261 0.95 CDK6 (0.40) CDK6CDK4CSF1RCDK2CCNA2
SCHEMBL31334329 0.89 CDK9 (0.42) CDK6CDK4CDK2CCNA2CDK5
SCHEMBL31334455 0.89 CDK9 (0.42) CDK6CDK4CDK2CCNA2CDK5
SCHEMBL31333633 0.89 MAP4K1 (0.47) CDK6CDK2CCNA2MAPK1MAPK3
SCHEMBL31333839 0.87 MAPK1 (0.42) CDK4CDK2CCNA2CDK5CDK5R1
SCHEMBL31334958 0.86 MAPK1 (0.45) CDK6CDK4CSF1RCDK2CCNA2
SCHEMBL31334703 0.86 MAPK1 (0.42) CDK4CDK2CCNA2CDK5CDK5R1
SCHEMBL31334173 0.86 MAPK1 (0.42) CDK4CDK2CCNA2CDK5CDK5R1
SCHEMBL31333290 0.84 CDK9 (0.41) CDK6CDK4CDK2CCNA2CDK5
SCHEMBL31334120 0.84 SYK (0.45) CDK6CDK4CDK2CCNA2CDK5

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