SCHEMBL30919906

SCHEMBL30919906

O[C@@H]1CCCN(c2nc(Cl)ncc2Cl)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNE2 O96020 1/20 0.41
CCNE1 P24864 1/20 0.41
CDK2 P24941 1/20 0.41
MAPK13 O15264 1/20 0.40
MAPK12 P53778 1/20 0.40
MAPK11 Q15759 1/20 0.40
MAPK14 Q16539 1/20 0.40
ALDH1A1 P00352 2/20 0.40
SMPD3 Q9NY59 4/20 0.40
LRRK2 Q5S007 2/20 0.38
KDM4E B2RXH2 2/20 0.38
GAA P10253 1/20 0.38
HCRTR2 O43614 1/20 0.38
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
TP53 P04637 1/20 0.37
ALOX15 P16050 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
KMT2A Q03164 1/20 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
SCHEMBL30919856 1.00 CCNE2 (0.41) CCNE2CCNE1CDK2MAPK13MAPK12
SCHEMBL30919792 1.00 CCNE2 (0.41) CCNE2CCNE1CDK2MAPK13MAPK12
SCHEMBL31262462 0.86 MAPK13 (0.41) CCNE2CCNE1CDK2MAPK13MAPK12
SCHEMBL30919913 0.82 SMN1; SMN2 (0.36) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL30919727 0.82 SMN1; SMN2 (0.36) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL30919945 0.82 NPC1 (0.46) LRRK2KDM4EHCRTR2NPC1TP53
SCHEMBL30919604 0.82 SMN1; SMN2 (0.36) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL15022112 0.81 ALDH1A1 (0.50) ALDH1A1KDM4EHCRTR2MEN1KMT2A
SCHEMBL30919519 0.79 MAP4K4 (0.43) LRRK2GAAHCRTR2MEN1KMT2A
SCHEMBL1935226 0.79 SMN1; SMN2 (0.49) ALDH1A1HCRTR2SMN1; SMN2

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-4618755-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN Larkspur Biosciences, Inc. (US) 2025-09-24 EP disclosed
WO-2024107746-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN LARKSPUR BIOSCIENCES (US) 2024-05-23 WO disclosed