SCHEMBL31334261

SCHEMBL31334261

O=C1OCCCN1c1cccc(-c2nc(NC3CCNCC3)ncc2F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK6 Q00534 7/20 0.40
CDK4 P11802 5/20 0.40
CCND1 P24385 3/20 0.40
CCND3 P30281 1/20 0.40
CDK2 P24941 5/20 0.40
MAPK1 P28482 4/20 0.40
CCNA2 P20248 3/20 0.40
CDK9 P50750 3/20 0.40
CCNK O75909 2/20 0.40
CDK7 P50613 2/20 0.40
CCNH P51946 2/20 0.40
CSF1R P07333 2/20 0.40
CDK5 Q00535 2/20 0.40
CDK5R1 Q15078 2/20 0.40
PIK3CD O00329 2/20 0.39
DYRK2 Q92630 2/20 0.39
MAPK3 P27361 1/20 0.39
MAPK8 P45983 2/20 0.38
CCNT1 O60563 2/20 0.38
CCNE1 P24864 2/20 0.38

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
SCHEMBL31334897 0.95 CDK6 (0.42) CDK6CDK4CCND1CCND3CDK2
SCHEMBL31333396 0.90 CDK6 (0.42) CDK6CDK4CCND1CCND3CDK2
SCHEMBL31334717 0.90 ADORA1 (0.43) CDK6CDK4CDK2MAPK1CCNA2
SCHEMBL31333290 0.90 CDK9 (0.41) CDK6CDK4CDK2MAPK1CCNA2
SCHEMBL31333597 0.87 MAPK1 (0.41) CDK4CCND1CDK2MAPK1CCNA2
SCHEMBL31334975 0.87 MAPK1 (0.41) CDK4CCND1CDK2MAPK1CCNA2
SCHEMBL31334417 0.87 MAPK1 (0.41) CDK4CCND1CDK2MAPK1CCNA2
SCHEMBL31334262 0.87 MAPK1 (0.41) CDK4CCND1CDK2MAPK1CCNA2
SCHEMBL31334163 0.87 MAPK1 (0.44) CDK6CDK4CCND1CCND3CDK2
SCHEMBL31334120 0.86 SYK (0.45) CDK6CDK4CCND1CCND3CDK2

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