SCHEMBL31333355

SCHEMBL31333355

CC(=O)N1CCCC(c2cccc(-c3nc(NC4CCCC(C(N)=O)C4)ncc3F)c2)C1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BTK Q06187 2/20 0.47
JAK3 P52333 1/20 0.47
MAPK3 P27361 5/20 0.44
DYRK2 Q92630 1/20 0.40
CDK4 P11802 1/20 0.40
CCND1 P24385 1/20 0.40
CCND3 P30281 1/20 0.40
CDK6 Q00534 1/20 0.40
MAPK1 P28482 5/20 0.39
SYK P43405 2/20 0.38
EGFR P00533 2/20 0.37
ITK Q08881 1/20 0.37
GRM5 P41594 1/20 0.37
MAPK10 P53779 2/20 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
SCHEMBL31334463 0.93 BTK (0.48) BTKJAK3MAPK3DYRK2CDK4
SCHEMBL31333214 0.92 BTK (0.47) BTKJAK3MAPK3DYRK2CDK4
SCHEMBL31334771 0.89 SYK (0.42) MAPK3DYRK2MAPK1SYK
SCHEMBL31333240 0.88 JAK3 (0.49) BTKJAK3DYRK2CDK4CCND1
SCHEMBL31334825 0.85 JAK3 (0.48) BTKJAK3MAPK3DYRK2CDK4
SCHEMBL31334502 0.84 MAPK3 (0.39) BTKMAPK3MAPK1SYK
SCHEMBL31333828 0.81 MAPK3 (0.43) BTKMAPK3DYRK2MAPK1
SCHEMBL31333561 0.81 MAPK3 (0.43) BTKMAPK3DYRK2MAPK1
SCHEMBL31333422 0.81 MAPK3 (0.44) MAPK3MAPK1SYK
SCHEMBL31334543 0.80 SYK (0.44) JAK3MAPK3DYRK2MAPK1SYK

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