SCHEMBL31483014

SCHEMBL31483014

NC(=O)NCCCN1CCNCC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.49
HSD17B10 Q99714 2/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
LMNA P02545 2/20 0.44
KDM4E B2RXH2 2/20 0.44
HTR1A P08908 1/20 0.44
DRD2 P14416 1/20 0.44
HTR2A P28223 1/20 0.44
HTR7 P34969 1/20 0.44
HTR6 P50406 1/20 0.44
TP53 P04637 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CXCR4 P61073 2/20 0.43
ANPEP P15144 1/20 0.42
ERAP2 Q6P179 1/20 0.42
SIGMAR1 Q99720 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 2/20 0.40
USP2 O75604 1/20 0.39

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
SCHEMBL10641947 0.94 CXCR4 (0.54) GAAHSD17B10MEN1KMT2ALMNA
SCHEMBL10704880 0.89 HSD17B10 (0.59) GAAHSD17B10MEN1KMT2AKDM4E
SCHEMBL14861110 0.84 HSD17B10 (0.49) GAAHSD17B10MEN1KMT2ALMNA
SCHEMBL28577177 0.83 DRD2 (0.46) GAAHSD17B10MEN1KMT2ALMNA
SCHEMBL8594860 0.83 GAA (0.53) GAAHSD17B10LMNAKDM4EHTR1A
SCHEMBL8139296 0.82 MEN1 (0.49) GAAHSD17B10MEN1KMT2ALMNA
SCHEMBL2755852 0.81 L3MBTL1 (0.52) GAALMNAKDM4ETP53SMN1; SMN2
SCHEMBL3265179 0.80 SMN1; SMN2 (0.53) GAAHSD17B10KMT2ALMNAKDM4E
SCHEMBL12099574 0.79 DRD2 (0.61) GAALMNAKDM4EHTR1ADRD2
SCHEMBL11555 0.79 TP53 (0.53) HSD17B10MEN1KMT2ALMNADRD2

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
CN-119841829-A Compounds for the treatment of PI3K gamma mediated diseases and uses thereof 中国科学院合肥物质科学研究院 2025-04-18 CN disclosed