SCHEMBL11153759

SCHEMBL11153759

CCOc1ccc(S)c(Cl)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ HPGD P15428 2/20 0.38
▸ KDM4E B2RXH2 3/20 0.37
▸ HSD17B10 Q99714 3/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ L3MBTL1 Q9Y468 4/20 0.37
▸ MAPT P10636 3/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ RORC P51449 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ NQO1 P15559 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HTR2C P28335 2/20 0.33
▸ HTR2B P41595 2/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ NPC1 O15118 1/20 0.33

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
SCHEMBL3719155 0.79 HPGD (0.40) TSHRALDH1A1HPGDKDM4EHSD17B10
SCHEMBL12300309 0.78 L3MBTL1 (0.42) TSHRALDH1A1HPGDKDM4EMAPK1
SCHEMBL19155762 0.77 MAPT (0.41) TSHRALDH1A1HPGDKDM4EHSD17B10
SCHEMBL10726742 0.76 KDM4E (0.40) ALDH1A1HPGDKDM4EMAPK1L3MBTL1
SCHEMBL24022121 0.75 MAPT (0.52) TSHRALDH1A1HPGDKDM4EHSD17B10
SCHEMBL22787328 0.75 MAPT (0.44) TSHRALDH1A1HPGDKDM4EHSD17B10
SCHEMBL3785688 0.73 ALDH1A1 (0.52) ALDH1A1KDM4EL3MBTL1MAPTRAB9A
SCHEMBL7735282 0.72 L3MBTL1 (0.44) TSHRALDH1A1HPGDKDM4EHSD17B10
SCHEMBL18052935 0.72 MAPT (0.41) TSHRALDH1A1HPGDKDM4EHSD17B10
SCHEMBL19154831 0.72 TSHR (0.37) TSHRALDH1A1HPGDKDM4EMAPK1

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
US-4389416-A DIURETICS ABBOTT LABORATORIES (US) 1983-06-21 — — US disclosed
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