SCHEMBL7775644

SCHEMBL7775644

CN(C)S(=O)(=O)CCCCCCN1CCN(C(c2ccccc2)c2cc(F)ccn2)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 10/20 0.45
▸ ALDH1A1 P00352 2/20 0.43
▸ MAPT P10636 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ DRD2 P14416 3/20 0.41
▸ DRD3 P35462 3/20 0.41
▸ DRD4 P21917 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ALOX5 P09917 2/20 0.40

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
Hydrochloric Acid SCHEMBL7775560 0.87 ALDH1A1 (0.41) P2RX7ALDH1A1MAPTMAPK1HTT
SCHEMBL7773719 0.87 P2RX7 (0.47) P2RX7ALDH1A1MAPTMAPK1HTT
SCHEMBL7775646 0.86 OPRD1 (0.46) P2RX7DRD2DRD3DRD4
SCHEMBL7098294 0.81 DRD2 (0.42) P2RX7ALDH1A1MAPTMAPK1HTT
SCHEMBL7097689 0.78 DRD3 (0.60) DRD2DRD3DRD4
SCHEMBL7097673 0.78 DRD3 (0.60) DRD2DRD3DRD4
Hydrochloric Acid SCHEMBL7775567 0.73 OPRD1 (0.49) DRD2DRD3DRD4
SCHEMBL7103907 0.72 DRD2 (0.42) P2RX7ALDH1A1MAPTMAPK1HTT
SCHEMBL7773713 0.72 DRD2 (0.52) P2RX7DRD2DRD3DRD4
SCHEMBL7097627 0.69 DRD3 (0.59) DRD2DRD3DRD4

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-0690051-B1 DIAZACYCLOALKANEALKYLSULFONAMIDE DERIVATIVE AZWELL INC (JP) 2001-07-18 — — EP disclosed
EP-0690051-A1 DIAZACYCLOALKANEALKYLSULFONAMIDE DERIVATIVE NIPPON SHOJI KABUSHIKI KAISHA (JP) 1996-01-03 — — EP disclosed
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