SCHEMBL7506690

SCHEMBL7506690

Nc1c[c]c(Sc2nc3cc(Cl)ccc3s2)c(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ PPARA Q07869 7/20 0.43
▸ LOXL2 Q9Y4K0 1/20 0.42
▸ IDO1 P14902 1/20 0.42
▸ CTRC Q99895 2/20 0.41
▸ GLB1 P16278 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.40
▸ HSP90AB1 P08238 1/20 0.40
▸ ALOX5 P09917 2/20 0.40
▸ TMEM97 Q5BJF2 2/20 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
SCHEMBL7575462 0.81 SMN1; SMN2 (0.47) SMN1; SMN2NPSR1PPARACTRCGLB1
SCHEMBL8564013 0.76 SMN1; SMN2 (0.59) SMN1; SMN2NPSR1PPARALOXL2IDO1
SCHEMBL12585006 0.75 SMN1; SMN2 (0.55) SMN1; SMN2NPSR1PPARALOXL2IDO1
SCHEMBL12584997 0.73 SMN1; SMN2 (0.58) SMN1; SMN2NPSR1PPARALOXL2IDO1
SCHEMBL8523609 0.71 SMN1; SMN2 (0.74) SMN1; SMN2NPSR1PPARALOXL2IDO1
SCHEMBL12585031 0.71 SMN1; SMN2 (0.56) SMN1; SMN2NPSR1PPARALOXL2IDO1
SCHEMBL5713076 0.71 SMN1; SMN2 (0.46) SMN1; SMN2NPSR1PPARALOXL2CTRC
SCHEMBL2034875 0.71 PPARA (0.49) SMN1; SMN2NPSR1PPARACTRCGLB1
SCHEMBL8560277 0.70 SMN1; SMN2 (0.59) SMN1; SMN2NPSR1PPARALOXL2IDO1
SCHEMBL7496577 0.70 PDK1 (0.40) SMN1; SMN2NPSR1PPARA

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-1192137-A1 COMPOUNDS FOR THE MODULATION OF PPAR$g(g) ACTIVITY Tularik Inc. (US) 2002-04-03 — — EP disclosed
WO-2001000579-A1 COMPOUNDS FOR THE MODULATION OF PPARη ACTIVITY TULARIK INC. (US) 2001-01-04 — — WO disclosed
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