SCHEMBL8932656

SCHEMBL8932656

Cc1nn(-c2ccccc2)nc1Cc1cc2cc(CC3SC(=O)NC3=O)ccc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PPARG P37231 7/20 0.40
MAOA P21397 2/20 0.39
CISD1 Q9NZ45 2/20 0.39
PTPN1 P18031 2/20 0.39
MAOB P27338 1/20 0.38
FFAR1 O14842 6/20 0.37
MAPT P10636 1/20 0.36
PPARA Q07869 2/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL8932654 0.79 PPARG (0.47) ALDH1A1NPSR1PPARGMAOACISD1
SCHEMBL8932655 0.78 ALDH1A1 (0.43) ALDH1A1NPSR1PPARGMAOACISD1
SCHEMBL9573682 0.69 PPARG (0.42) ALDH1A1NPSR1PPARGMAOACISD1
SCHEMBL8932685 0.67 HDAC8 (0.53) ALDH1A1NPSR1PPARGMAOACISD1
SCHEMBL13846702 0.67 PPARG (0.59) ALDH1A1NPSR1PPARGMAOACISD1
SCHEMBL8932730 0.65 FFAR1 (0.42) ALDH1A1NPSR1PPARGMAOACISD1
SCHEMBL4773524 0.65 PPARG (0.53) ALDH1A1NPSR1PPARGMAOACISD1
SCHEMBL1016492 0.64 PPARG (0.57) PPARGFFAR1PPARACYP3A4
SCHEMBL166570 0.64 PPARG (0.74) ALDH1A1NPSR1PPARGMAOACISD1
SCHEMBL4857396 0.64 PPARG (0.56) ALDH1A1PPARGFFAR1MAPTPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996026207-A1 THIAZOLIDINE AND OXAZOLIDINE INDOLES WITH HYPOCLYCEMIC ACTIVITY NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1996-08-29 WO disclosed