SCHEMBL31334963

SCHEMBL31334963

O=C(N[C@H]1CC[C@H](Nc2ncc(F)c(-c3cccc(-c4ccc[nH]c4=O)c3)n2)CC1)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK9 P50750 3/20 0.43
CCNT1 O60563 2/20 0.43
CCNK O75909 2/20 0.43
CCNE1 P24864 2/20 0.43
CDK2 P24941 2/20 0.43
CDK12 Q9NYV4 2/20 0.43
ADORA1 P30542 5/20 0.40
MAPK1 P28482 6/20 0.39
ADORA2A P29274 3/20 0.39
ADORA2B P29275 1/20 0.39
MAP4K1 Q92918 1/20 0.38
NPR1 P16066 1/20 0.37
MAPK10 P53779 2/20 0.37
MAPK8 P45983 1/20 0.37
MAPK9 P45984 1/20 0.37
JUN P05412 1/20 0.36
MCHR1 Q99705 1/20 0.36
CDK7 P50613 2/20 0.36
CCNH P51946 1/20 0.36
MNAT1 P51948 1/20 0.36

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
SCHEMBL31335133 0.89 CCNE1 (0.43) CDK9CCNT1CCNKCCNE1CDK2
SCHEMBL31333686 0.88 ADORA1 (0.44) CDK9CCNT1CCNKCCNE1CDK2
SCHEMBL31334122 0.87 CDK2 (0.43) CDK9CCNT1CCNKCCNE1CDK2
SCHEMBL31334804 0.87 CDK2 (0.43) CDK9CCNT1CCNKCCNE1CDK2
SCHEMBL31334085 0.87 MAPK10 (0.49) CDK9CCNT1CCNKCCNE1CDK2
SCHEMBL31334553 0.87 CDK2 (0.42) CDK9CCNT1CCNKCCNE1CDK2
SCHEMBL31335063 0.87 CDK2 (0.42) CDK9CCNT1CCNKCCNE1CDK2
SCHEMBL31334998 0.86 CCNT1 (0.45) CDK9CCNT1CCNKCCNE1CDK2
SCHEMBL31333986 0.86 CCNT1 (0.45) CDK9CCNT1CCNKCCNE1CDK2
SCHEMBL31334899 0.85 CCNT1 (0.43) CDK9CCNT1CCNKCCNE1CDK2

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