SCHEMBL6264286

SCHEMBL6264286

Cc1cc(C(=O)N2CCN(c3cccc(Cl)c3)CC2)[nH]n1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.58
▸ HTT P42858 3/20 0.58
▸ ALDH1A1 P00352 2/20 0.58
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ NPSR1 Q6W5P4 1/20 0.58
▸ LMNA P02545 2/20 0.56
▸ TACR3 P29371 1/20 0.55
▸ HTR1A P08908 1/20 0.54
▸ HTR2A P28223 1/20 0.54
▸ HTR7 P34969 1/20 0.54
▸ HTR6 P50406 1/20 0.54
▸ CA12 O43570 1/20 0.53
▸ CA1 P00915 1/20 0.53
▸ CA9 Q16790 1/20 0.53
▸ USP2 O75604 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ KMT2A Q03164 1/20 0.53

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
SCHEMBL13453343 0.74 HTR1A (0.71) TSHRHTTALDH1A1SMN1; SMN2NPSR1
SCHEMBL29495713 0.74 LMNA (0.65) TSHRHTTALDH1A1SMN1; SMN2NPSR1
SCHEMBL6259088 0.74 LMNA (0.65) TSHRHTTALDH1A1SMN1; SMN2NPSR1
SCHEMBL94576 0.73 SMN1; SMN2 (0.68) TSHRHTTALDH1A1SMN1; SMN2NPSR1
SCHEMBL1458090 0.72 HTR1A (0.73) TSHRALDH1A1SMN1; SMN2HTR1AHTR2A
SCHEMBL5537738 0.72 HTR1A (0.73) ALDH1A1SMN1; SMN2HTR1AHTR2AHTR7
SCHEMBL8001697 0.72 ALPL (0.54) HTTALDH1A1SMN1; SMN2TACR3MAPT
SCHEMBL17884901 0.72 RAB9A (0.72) HTTALDH1A1SMN1; SMN2HTR1AHTR2A
SCHEMBL11100857 0.72 ALDH1A1 (0.75) HTTALDH1A1SMN1; SMN2LMNAHTR1A
SCHEMBL6714846 0.72 ALDH1A1 (0.75) HTTALDH1A1SMN1; SMN2LMNAHTR1A

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-1590329-A1 N-ARYL HETEROAROMATIC PRODUCTS, COMPOSITIONS CONTAINING SAME AND USE THEREOF Aventis Pharma S.A. (FR) 2005-11-02 — — EP disclosed
WO-2004078732-A1 N-ARYL HETEROAROMATIC PRODUCTS, COMPOSITIONS CONTAINING SAME AND USE THEREOF AVENTIS PHARMA S.A. (FR) 2004-09-16 — — WO disclosed
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