SCHEMBL25948966

SCHEMBL25948966

CC(C)(C)OC(=O)N(C(=O)O)c1ncnc2c1ccn2[C@H]1CC[C@@H](CO)O1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 1/20 0.37
▸ RIN1 Q13671 1/20 0.37
▸ PDPK1 O15530 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ ALB P02768 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ GPR119 Q8TDV5 3/20 0.34
▸ JAK3 P52333 1/20 0.32
▸ SRC P12931 2/20 0.31

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
SCHEMBL23892335 1.00 ABL1 (0.37) ABL1RIN1PDPK1ALDH1A1LMNA
SCHEMBL18571923 0.95 PDPK1 (0.40) ABL1RIN1PDPK1ALDH1A1LMNA
SCHEMBL18572228 0.95 PDPK1 (0.40) ABL1RIN1PDPK1ALDH1A1LMNA
SCHEMBL22002163 0.81 PDPK1 (0.37) PDPK1GPR119JAK3
SCHEMBL25949266 0.81 PDPK1 (0.37) PDPK1GPR119JAK3
SCHEMBL22002066 0.80 PDPK1 (0.36) PDPK1GPR119JAK3
SCHEMBL23892341 0.80 PDPK1 (0.36) PDPK1GPR119JAK3
SCHEMBL22799584 0.80 ALDH1A1 (0.50) ABL1RIN1ALDH1A1LMNAALB
SCHEMBL18571622 0.80 ALDH1A1 (0.50) ABL1RIN1ALDH1A1LMNAALB
SCHEMBL18571908 0.77 METTL3 (0.39) PDPK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4219496-A1 NOVEL 6-6 BICYCLIC AROMATIC RING SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN Pharmaceutica NV (BE) 2023-08-02 — — EP disclosed
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