SCHEMBL7087030

SCHEMBL7087030

CCc1c(Oc2nc3cc(Cl)ccc3s2)cc([N+](=O)[O-])cc1C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.40
LMNA P02545 3/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 2/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
HDAC6 Q9UBN7 1/20 0.35
ALOX5 P09917 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MITF O75030 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CCR6 P51684 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MMP13 P45452 1/20 0.35
LOXL2 Q9Y4K0 1/20 0.34
CASP1 P29466 1/20 0.34

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
SCHEMBL2003706 0.72 PPARA (0.44) PPARALMNAMAPTHTTKMT2A
SCHEMBL7087028 0.71 MAOA (0.41) PPARALMNAMAPTHTTKMT2A
SCHEMBL28888306 0.67 HTT (0.56) LMNAMAPTHTTKMT2ASMN1; SMN2
SCHEMBL2001919 0.65 LOXL2 (0.51) PPARAMAOAMAOBHDAC6ALOX5
SCHEMBL2029836 0.64 PPARA (0.47) PPARALMNAMAPTHTTKMT2A
SCHEMBL11014769 0.64 EIF4E (0.46) PPARAMAOAMAOBHDAC6MMP13
SCHEMBL11205218 0.64 SMN1; SMN2 (0.51) PPARAHTTKMT2AHDAC6ALOX5
SCHEMBL11354762 0.64 PTGS1 (0.45) PPARAMAPTKMT2AHSD17B10HDAC6
SCHEMBL3711953 0.62 SMN1; SMN2 (0.53) PPARALMNAMAPTHTTKMT2A
SCHEMBL14060990 0.62 NPC1 (0.48) LMNAMAPTHTTKMT2AMEN1

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-1296967-A1 QUINOLINYL AND BENZOTHIAZOLYL PPAR-GAMMA MODULATORS Tularik Inc. (US) 2003-04-02 EP disclosed
WO-2002000633-A1 QUINOLINYL AND BENZOTHIAZOLYL PPAR-GAMMA MODULATORS TULARIK INC. (US) 2002-01-03 WO disclosed