SCHEMBL8313621

SCHEMBL8313621

Cc1ccc(S(=O)(=O)CC2CCc3ccc4c(c3O2)CC(=O)N4)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.53
DRD4 P21917 1/20 0.53
DRD3 P35462 1/20 0.53
CRBN Q96SW2 4/20 0.46
HTR1D P28221 1/20 0.39
HTR1B P28222 1/20 0.39
PKM P14618 3/20 0.37
GAA P10253 2/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
ALPG P10696 1/20 0.35
CYP2C19 P33261 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ADRA1D P25100 4/20 0.35
SLC6A4 P31645 4/20 0.35
ADRA1A P35348 4/20 0.35
ADRA1B P35368 4/20 0.35
GBA1 P04062 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL8312627 0.78 DRD2 (0.81) DRD2DRD4DRD3
SCHEMBL8317510 0.77 DRD2 (0.64) DRD2DRD4DRD3HTR1DHTR1B
SCHEMBL8643128 0.77 DRD2 (0.64) DRD2DRD4DRD3HTR1DHTR1B
SCHEMBL8314765 0.74 DRD2 (0.68) DRD2DRD4DRD3HTR1DHTR1B
SCHEMBL5156793 0.73 CRBN (0.51) CRBNGAACYP1A2CYP2C19MEN1
SCHEMBL2115589 0.73 CRBN (0.51) CRBNGAACYP1A2CYP2C19MEN1
SCHEMBL2115582 0.73 CRBN (0.51) CRBNGAACYP1A2CYP2C19MEN1
SCHEMBL3035136 0.71 DRD2 (0.37) DRD2DRD4DRD3PKMGAA
SCHEMBL5954233 0.71 DRD2 (0.37) DRD2DRD4DRD3PKMGAA
SCHEMBL3039847 0.71 DRD2 (0.37) DRD2DRD4DRD3PKMGAA

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
EP-0771801-B1 Chromane derivatives AMERICAN HOME PROD (US) 1999-03-03 EP disclosed
EP-0771801-A1 Chromane derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1997-05-07 EP disclosed