SCHEMBL10746246

SCHEMBL10746246

N#Cc1ccc2[nH]cc(CCCN3C(=O)c4ccccc4C3=O)c2c1

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.70
▸ MEN1 O00255 4/20 0.70
▸ KMT2A Q03164 4/20 0.70
▸ LMNA P02545 3/20 0.70
▸ TDP1 Q9NUW8 2/20 0.70
▸ HTT P42858 1/20 0.70
▸ TP53 P04637 1/20 0.70
▸ SMN1; SMN2 Q16637 1/20 0.66
▸ GAA P10253 2/20 0.60
▸ NPC1 O15118 1/20 0.57
▸ RAB9A P51151 1/20 0.57
▸ HTR1A P08908 6/20 0.56
▸ SLC6A4 P31645 1/20 0.56

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
SCHEMBL14017318 0.97 MAPT (0.65) MAPTMEN1KMT2ALMNATDP1
SCHEMBL9828298 0.93 GAA (0.69) MAPTMEN1KMT2ALMNATDP1
SCHEMBL10752984 0.82 MAPT (0.74) MAPTMEN1KMT2ALMNATDP1
SCHEMBL10741943 0.81 MAPT (0.71) MAPTMEN1KMT2ALMNATDP1
SCHEMBL14044219 0.79 MAPT (0.69) MAPTMEN1KMT2ALMNATDP1
SCHEMBL10716480 0.78 GAA (0.67) MAPTMEN1KMT2ALMNATDP1
SCHEMBL6218060 0.78 SLC6A4 (0.49) HTR1ASLC6A4
Hydrochloric Acid SCHEMBL7676694 0.77 SLC6A4 (0.49) HTR1ASLC6A4
SCHEMBL21225808 0.77 MAPT (0.90) MAPTMEN1KMT2ALMNATDP1
SCHEMBL27842093 0.77 SLC6A4 (0.64) SLC6A4

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
US-4672067-A 5-substituted 3-aminoalkyl indoles useful in treatment of migraine GLAXO GROUP LIMITED (GB) 1987-06-09 — — US disclosed
US-4252803-A HYPOTENSIVE AGENTS, ANALGESICS GLAXO GROUP LIMITED (GB) 1981-02-24 — — US disclosed
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