SCHEMBL30712480

SCHEMBL30712480

CN1CCN(CCCOC(=O)C(C)(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.64
HRH3 Q9Y5N1 4/20 0.53
DRD3 P35462 2/20 0.53
CHRM2 P08172 4/20 0.52
CHRM4 P08173 4/20 0.52
CHRM1 P11229 4/20 0.52
CHRM3 P20309 4/20 0.52
CHRM5 P08912 3/20 0.52
HTT P42858 1/20 0.52
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
GAA P10253 1/20 0.50
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 2/20 0.47
POLB P06746 1/20 0.47
RAD52 P43351 1/20 0.47
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL30343549 0.91 HTT (0.54) ALDH1A1CHRM2CHRM4CHRM1CHRM3
SCHEMBL9588270 0.88 ALDH1A1 (0.68) ALDH1A1CHRM2CHRM4CHRM1CHRM3
Hydrochloric Acid SCHEMBL9589541 0.86 ALDH1A1 (0.67) ALDH1A1CHRM2CHRM4CHRM1CHRM3
SCHEMBL13239697 0.78 ALDH1A1 (0.48) ALDH1A1HRH3DRD3CHRM3HTT
SCHEMBL10029779 0.77 CHRM2 (0.66) ALDH1A1CHRM2CHRM4CHRM1CHRM3
SCHEMBL5072133 0.76 CHRM2 (0.60) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL16845085 0.73 HRH3 (0.50) ALDH1A1HRH3DRD3CHRM3MEN1
SCHEMBL11176012 0.72 ALDH1A1 (0.45) ALDH1A1HRH3HTTMEN1KMT2A
SCHEMBL11396752 0.72 ALDH1A1 (0.58) ALDH1A1HRH3DRD3CHRM2CHRM4
SCHEMBL314121 0.72 HTR1A (0.57) HRH3DRD3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4558526-A1 BINDING MOLECULES TARGETING IL-35R VIB VZW (BE) 2025-05-28 EP disclosed
US-20240228596-A1 PAN-SPECIFIC CORONA VIRUS BINDERS UNIVERSITEIT GENT (BE) 2024-07-11 US disclosed
CN-118103395-A Pan-specific coronavirus binding agents VIB研究所 2024-05-28 CN disclosed
WO-2024018242-A1 BINDING MOLECULES TARGETING IL-35R DUALYX NV (BE) 2024-01-25 WO disclosed