SCHEMBL31334377

SCHEMBL31334377

NC(=O)C1CCCC(Nc2ncc(F)c(-c3cccc(-c4cc[nH]c(=O)c4)c3)n2)C1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CDK7 P50613 6/20 0.39
CCNT1 O60563 3/20 0.39
CDK9 P50750 3/20 0.39
CDK2 P24941 3/20 0.39
CCNK O75909 2/20 0.39
CCNE1 P24864 2/20 0.39
CDK12 Q9NYV4 2/20 0.39
MAPK3 P27361 2/20 0.38
CCNH P51946 3/20 0.37
MNAT1 P51948 3/20 0.37
MAPK8 P45983 2/20 0.36
ALDH2 P05091 2/20 0.36
CD38 P28907 1/20 0.35
MAPK1 P28482 3/20 0.35
ADORA1 P30542 1/20 0.35
SYK P43405 2/20 0.35
IRAK1 P51617 1/20 0.35
CCNA2 P20248 1/20 0.34

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
SCHEMBL31333885 0.92 MAPK3 (0.40) CDK7CCNT1CDK9CDK2CCNK
SCHEMBL31333221 0.90 ADORA1 (0.39) CCNT1CDK9CDK2CCNKCCNE1
SCHEMBL31333422 0.89 MAPK3 (0.44) CDK7CCNT1CDK9CDK2CCNK
SCHEMBL31334624 0.89 CCNK (0.41) CDK7CCNT1CDK9CDK2CCNK
SCHEMBL31334625 0.86 CCNT1 (0.45) CDK7CCNT1CDK9CDK2CCNK
SCHEMBL31334366 0.86 CCNT1 (0.45) CDK7CCNT1CDK9CDK2CCNK
SCHEMBL31334707 0.86 MAPK3 (0.38) CDK7CCNT1CDK9CDK2CCNK
SCHEMBL31333585 0.84 ADORA1 (0.41) CDK2CCNE1MAPK3ALDH2MAPK1
SCHEMBL31334771 0.83 SYK (0.42) CDK7CCNT1CDK9CDK2CCNK
SCHEMBL31334123 0.81 MAPK3 (0.47) CDK7CCNT1CDK9CDK2CCNK

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