SCHEMBL23964156

SCHEMBL23964156

C=C(C)/C(C)=C(\N)N1CCN(Cc2cc3cc(Cl)ccc3[nH]2)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 1/20 0.45
DRD3 P35462 5/20 0.45
DRD2 P14416 4/20 0.45
DRD4 P21917 4/20 0.45
LOXL2 Q9Y4K0 1/20 0.44
CHEK1 O14757 1/20 0.43
HRH4 Q9H3N8 7/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
HRH3 Q9Y5N1 2/20 0.41
HRH1 P35367 1/20 0.41
F10 P00742 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL25200874 0.78 SIRT1 (0.52) SIRT1DRD3DRD2DRD4LOXL2
SCHEMBL6381282 0.77 HRH4 (0.68) SIRT1DRD3DRD2DRD4LOXL2
SCHEMBL23932528 0.74 KMT2A (0.52) SIRT1DRD3DRD2DRD4CHEK1
SCHEMBL30040747 0.73 DRD3 (0.56) SIRT1DRD3DRD2DRD4LOXL2
SCHEMBL25505958 0.73 DRD3 (0.56) SIRT1DRD3DRD2DRD4LOXL2
SCHEMBL23964261 0.69 DRD4 (0.64) SIRT1DRD3DRD2DRD4LOXL2
SCHEMBL5796117 0.68 CHEK1 (0.58) CHEK1HRH4KMT2AMEN1HRH3
SCHEMBL4392078 0.68 F10 (0.66) SIRT1DRD3DRD2DRD4LOXL2
SCHEMBL30041947 0.67 DRD2 (0.49) DRD3DRD2DRD4LOXL2HRH4
SCHEMBL23932545 0.67 DRD2 (0.49) DRD3DRD2DRD4LOXL2HRH4

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
WO-2021216665-A1 COLLAGEN 1 TRANSLATION INHIBITORS AND METHODS OF USE THEREOF ANIMA BIOTECH INC. (US) 2021-10-28 WO disclosed