SCHEMBL9517244

SCHEMBL9517244

NC(CCCCN1C(=O)c2ccccc2C1=O)CSc1c[nH]c2ccc(Cl)cc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.59
▸ LMNA P02545 4/20 0.59
▸ MEN1 O00255 4/20 0.59
▸ KMT2A Q03164 4/20 0.59
▸ TDP1 Q9NUW8 2/20 0.59
▸ TP53 P04637 1/20 0.59
▸ DRD2 P14416 4/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ HTT P42858 1/20 0.44
▸ GAA P10253 2/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ IDO1 P14902 1/20 0.39
▸ HTR1A P08908 1/20 0.39
▸ DRD4 P21917 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ SLC6A4 P31645 1/20 0.39
▸ HTR7 P34969 1/20 0.39
▸ DRD3 P35462 1/20 0.39

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
SCHEMBL9517046 0.88 MAPT (0.54) MAPTLMNAMEN1KMT2ATDP1
SCHEMBL9513635 0.86 MAPT (0.61) MAPTLMNAMEN1KMT2ATDP1
SCHEMBL9516852 0.84 MAPT (0.40) MAPTLMNAMEN1KMT2ATDP1
SCHEMBL9513807 0.82 MEN1 (0.38) MAPTLMNAMEN1KMT2ATDP1
SCHEMBL9514280 0.81 HTR1A (0.44) HTR1A
SCHEMBL9513586 0.79 NPC1 (0.37) MAPTLMNAMEN1KMT2ATDP1
SCHEMBL9517210 0.73 MAPT (0.42) MAPTTDP1DRD2HTR1AHTR2A
SCHEMBL650217 0.72 MAPT (0.86) MAPTLMNAMEN1KMT2ATDP1
SCHEMBL9596924 0.71 MAPT (0.67) MAPTLMNAMEN1KMT2ATDP1
SCHEMBL9517236 0.71 HTR1A (0.43) MAPTTDP1DRD2GAAHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5227488-A AZA SPIRO DECANE AND USE THEREOF IN TREATING CNS DISORDERS NOVO NORDISK A/S (DK) 1993-07-13 — — US disclosed
EP-0495826-A1 INDOLE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1992-07-29 — — EP disclosed
WO-1991004973-A1 INDOLE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1991-04-18 — — WO disclosed
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