SCHEMBL31333903

SCHEMBL31333903

O=C1CCC(Nc2ccc(N3CCC(N4CCC(C(=O)N[C@H]5CC[C@H](Nc6ncc(F)c(-c7cccc(N8CCOCC8)c7)n6)CC5)CC4)CC3)c(F)c2)C(=O)N1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.39
JAK1 P23458 1/20 0.39
JAK3 P52333 1/20 0.39
BTK Q06187 2/20 0.38
CSF1R P07333 3/20 0.37
CDK4 P11802 3/20 0.37
CDK6 Q00534 3/20 0.37
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
MAPK1 P28482 2/20 0.35
SYK P43405 3/20 0.35
CCNT1 O60563 2/20 0.35
CCNA2 P20248 2/20 0.35
CDK2 P24941 2/20 0.35
CDK9 P50750 2/20 0.35
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP46A1 Q9Y6A2 1/20 0.33
VCP P55072 1/20 0.33

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
SCHEMBL31335033 0.95 BTK (0.38) JAK2JAK1JAK3BTKCSF1R
SCHEMBL31334348 0.95 BTK (0.38) JAK2JAK1JAK3BTKCSF1R
SCHEMBL31334982 0.94 CDK4 (0.38) JAK2JAK1JAK3BTKCSF1R
SCHEMBL31334051 0.93 CDK4 (0.36) JAK2JAK1JAK3BTKCSF1R
SCHEMBL31334989 0.93 CDK4 (0.38) JAK2JAK1JAK3BTKCSF1R
SCHEMBL31333881 0.92 BTK (0.35) JAK2JAK1JAK3BTKCSF1R
SCHEMBL31333720 0.92 CDK4 (0.36) JAK2JAK1JAK3BTKCSF1R
SCHEMBL31334880 0.92 CDK4 (0.39) JAK2JAK1JAK3BTKCSF1R
SCHEMBL31334658 0.91 JAK2 (0.37) JAK2JAK1JAK3BTKCSF1R
SCHEMBL31334459 0.91 CYP46A1 (0.39) BTKCSF1RCDK4CDK6DDB1

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