SCHEMBL26418294

SCHEMBL26418294

CNCCNC1CCN(c2ccc(C)cc2C)CC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
PRMT8 Q9NR22 1/20 0.44
ALDH1A1 P00352 3/20 0.42
MAPT P10636 2/20 0.42
MCOLN3 Q8TDD5 1/20 0.42
DRD2 P14416 7/20 0.41
DRD4 P21917 5/20 0.41
POLB P06746 1/20 0.40
HTT P42858 1/20 0.40
IGF1R P08069 1/20 0.39
GAA P10253 2/20 0.39
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
NR4A1 P22736 1/20 0.39
KMT2A Q03164 1/20 0.39
PTK2B Q14289 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL24123767 0.83 MAPT (0.47) ALDH1A1MAPTMCOLN3DRD2DRD4
SCHEMBL26407171 0.82 ADRB1 (0.46) CARM1PRMT6PRMT8ALDH1A1MCOLN3
SCHEMBL22942152 0.74 CARM1 (0.38) CARM1PRMT6PRMT8ALDH1A1MAPT
SCHEMBL24327052 0.72 CARM1 (0.39) CARM1PRMT6PRMT8ALDH1A1MAPT
SCHEMBL7715928 0.72 FFAR4 (0.39) MAPTGAAMEN1KMT2A
SCHEMBL26407207 0.72 OPRK1 (0.43) ALDH1A1DRD2DRD4HTTLMNA
SCHEMBL20374468 0.71 GAA (0.44) ALDH1A1MAPTGAALMNASMN1; SMN2
SCHEMBL23759702 0.71 CARM1 (0.38) CARM1PRMT6PRMT8DRD2DRD4
SCHEMBL26407206 0.71 ACACB (0.41) CARM1PRMT6PRMT8ALDH1A1MEN1
SCHEMBL13935733 0.71 MAPT (0.47) ALDH1A1MAPTMCOLN3DRD2DRD4

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-4169919-A1 PYRAZOLO[3,4-D]PYRIMIDINE-3-KETONE DERIVATIVE AS WEE-1 INHIBITOR Wigen Biomedicine Technology (Shanghai) Co., Ltd. (CN) 2023-04-26 EP disclosed