SCHEMBL29260004

SCHEMBL29260004

NC1CN(CC2CCN(Cc3ccccc3)CC2)C1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.61
ACHE P22303 1/20 0.54
ALDH1A1 P00352 2/20 0.54
CXCR4 P61073 1/20 0.54
SIGMAR1 Q99720 3/20 0.52
GAA P10253 2/20 0.50
DRD2 P14416 2/20 0.50
KDM4E B2RXH2 1/20 0.50
GLA P06280 1/20 0.50
MAPT P10636 1/20 0.50
HTT P42858 1/20 0.50
ATM Q13315 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
DRD4 P21917 1/20 0.50
DRD3 P35462 1/20 0.50
HTR2A P28223 1/20 0.50
HTR2C P28335 1/20 0.50
HTR2B P41595 1/20 0.50
HTR1A P08908 1/20 0.50

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
SCHEMBL239922 0.82 ACHE (0.58) CCR3ACHEALDH1A1SIGMAR1DRD2
SCHEMBL14793661 0.82 ACHE (0.58) CCR3ACHEALDH1A1SIGMAR1DRD2
SCHEMBL330609 0.82 ACHE (0.58) CCR3ACHEALDH1A1SIGMAR1DRD2
SCHEMBL42501 0.82 ACHE (0.58) CCR3ACHEALDH1A1SIGMAR1DRD2
SCHEMBL3604123 0.81 SIGMAR1 (0.65) CCR3ACHEALDH1A1SIGMAR1DRD4
SCHEMBL42207 0.81 ACHE (0.67) CCR3ACHEALDH1A1CXCR4SIGMAR1
Hydrochloric Acid SCHEMBL20507675 0.81 SIGMAR1 (0.57) CCR3ACHEALDH1A1SIGMAR1DRD4
Hydrochloric Acid SCHEMBL20446050 0.81 SIGMAR1 (0.57) CCR3ACHEALDH1A1SIGMAR1DRD4
SCHEMBL1088536 0.81 FUCA1 (0.60) CCR3ACHEALDH1A1SIGMAR1
SCHEMBL13232099 0.81 ACHE (0.58) CCR3ACHEALDH1A1CXCR4SIGMAR1

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-118076607-A Novel PLK1 degradation inducing compounds 厄普特拉株式会社 2024-05-24 CN disclosed