SCHEMBL6426507

SCHEMBL6426507

O=C(CC1SC(NC2CC3C=CC2C3)=NC1=O)Oc1ccccc1Cl

nearest known ligand 0.31

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA4 P48169 1/20 0.31
GABRE P78334 1/20 0.31
GABRA6 Q16445 1/20 0.31
GABRG1 Q8N1C3 1/20 0.31
GABRG3 Q99928 1/20 0.31
GABRQ Q9UN88 1/20 0.31
BCHE P06276 1/20 0.30
CXCL8 P10145 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL6506344 0.84 CISD1 (0.33) ALDH1A1
SCHEMBL1605665 0.83 ALDH1A1 (0.39) ALDH1A1
SCHEMBL6426010 0.81 MAPT (0.30)
SCHEMBL6427367 0.79 MAPT (0.37) ALDH1A1
SCHEMBL6499622 0.79 HPGD (0.35) ALDH1A1
SCHEMBL6429151 0.79 CYP2C19 (0.41) ALDH1A1
SCHEMBL6426184 0.79 HTT (0.40) ALDH1A1
SCHEMBL6502404 0.78 ALDH1A1 (0.49) ALDH1A1
SCHEMBL6506781 0.78 P2RX7 (0.39) ALDH1A1
SCHEMBL6427696 0.78 DPP8 (0.34) ALDH1A1

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-2005075471-A2 THIAZOL-COMPOUNDS AS 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS BIOVITRUM AB (SE) 2005-08-18 WO claimed
WO-2005075471-A2 THIAZOL-COMPOUNDS AS 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS BIOVITRUM AB (SE) 2005-08-18 WO disclosed