SCHEMBL31370877

SCHEMBL31370877

c1c[nH]c(CN2CCN(c3ccncc3)CC2)c1

nearest known ligand 0.75

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 10/20 0.75
DRD2 P14416 7/20 0.75
DRD3 P35462 7/20 0.75
HTR1A P08908 3/20 0.46
ADRB2 P07550 1/20 0.45
NCF1 P14598 1/20 0.45
PLD1 Q13393 1/20 0.45
CHKA P35790 1/20 0.44
POLB P06746 1/20 0.44
PARP1 P09874 1/20 0.41
HRH2 P25021 1/20 0.41
HRH1 P35367 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41

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
SCHEMBL27455010 0.82 DRD4 (0.75) DRD4DRD2DRD3HTR1A
SCHEMBL6701280 0.82 DRD4 (0.75) DRD4DRD2DRD3HTR1APOLB
SCHEMBL27563358 0.82
SCHEMBL3968181 0.82 DRD2 (0.73) DRD4DRD2DRD3HTR1APARP1
SCHEMBL6701277 0.76 DRD2 (0.66) DRD4DRD2DRD3HTR1APARP1
SCHEMBL7682702 0.75 DRD2 (0.64) DRD4DRD2DRD3PARP1HRH3
SCHEMBL12261943 0.74 DRD4 (0.77) DRD4DRD2DRD3POLBHRH1
SCHEMBL260734 0.74 DRD2 (0.63) DRD4DRD2DRD3NCF1HRH3
SCHEMBL28133126 0.74 DRD2 (0.63) DRD4DRD2DRD3NCF1CHKA
SCHEMBL27804123 0.74 DRD2 (0.63) DRD4DRD2DRD3POLBPARP1

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
CN-119775261-A Collagen 1 translation inhibitors and methods of use thereof 艾尼莫生物科技公司 2025-04-08 CN disclosed
CN-115427404-B Collagen 1 translation inhibitors and methods of use thereof 艾尼莫生物科技公司 2024-12-13 CN disclosed