SCHEMBL7998293

SCHEMBL7998293

COc1ccc(C=O)c(-c2ccsc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 5/20 0.51
PDGFRB P09619 3/20 0.51
PDGFRA P16234 3/20 0.51
MAOB P27338 2/20 0.51
MAOA P21397 1/20 0.51
ALDH1A1 P00352 3/20 0.50
TRIM24 O15164 1/20 0.49
TYR P14679 1/20 0.49
TRIM33 Q9UPN9 1/20 0.49
NPC1 O15118 1/20 0.46
CTSA P10619 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA3 P34903 1/20 0.43
GABRA2 P47869 1/20 0.43
PELI1 Q96FA3 1/20 0.43
GPBAR1 Q8TDU6 1/20 0.41
SIK1 P57059 1/20 0.41

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
SCHEMBL19153327 0.78 ALDH1A1 (0.53) ERN1PDGFRBPDGFRAALDH1A1TRIM24
SCHEMBL8782875 0.78 HDAC8 (0.59) ERN1ALDH1A1TRIM24TYRTRIM33
SCHEMBL8503242 0.78 MAOB (0.52) ERN1PDGFRBPDGFRAMAOBMAOA
SCHEMBL4740926 0.77 GPBAR1 (0.59) ERN1PDGFRBPDGFRAMAOBMAOA
SCHEMBL16697416 0.76 ALDH1A1 (0.54) ERN1ALDH1A1TRIM24TYRTRIM33
SCHEMBL14919460 0.76 ERN1 (0.51) ERN1PDGFRBPDGFRAMAOBPELI1
SCHEMBL18003620 0.76 PDGFRB (0.49) ERN1PDGFRBPDGFRAMAOBMAOA
SCHEMBL6535988 0.75 ERN1 (0.61) ERN1ALDH1A1TRIM24TRIM33PELI1
SCHEMBL18284498 0.75 ALDH1A1 (0.53) ERN1ALDH1A1TRIM24TYRTRIM33
SCHEMBL4392162 0.75 ALDH1A1 (0.53) ERN1MAOBALDH1A1TRIM24TYR

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
WO-2000008202-A9 3-METHYLIDENYL-2-INDOLINONE MODULATORS OF PROTEIN KINASE SUGEN INC (US) 2000-07-27 WO disclosed
WO-2000008202-A2 3-METHYLIDENYL-2-INDOLINONE MODULATORS OF PROTEIN KINASE SUGEN, INC. (US) 2000-02-17 WO disclosed