SCHEMBL7716422

SCHEMBL7716422

O=C(O)Nc1cc(Cl)ccc1Sc1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 4/20 0.71
▸ MAPK1 P28482 1/20 0.71
▸ MEN1 O00255 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ ALDH1A1 P00352 2/20 0.50
▸ BLM P54132 2/20 0.50
▸ PDE7A Q13946 1/20 0.50
▸ PDE7B Q9NP56 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ NOD2 Q9HC29 1/20 0.50
▸ TDP1 Q9NUW8 2/20 0.49
▸ MAPT P10636 1/20 0.49

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
SCHEMBL11704633 0.88 L3MBTL1 (0.67) L3MBTL1MAPK1MEN1LMNAKMT2A
SCHEMBL3525569 0.80 L3MBTL1 (0.68) L3MBTL1MAPK1MEN1LMNAKMT2A
SCHEMBL4654049 0.80 TDP1 (0.72) L3MBTL1MAPK1MEN1LMNAKMT2A
SCHEMBL16676218 0.79 L3MBTL1 (0.56) L3MBTL1MAPK1MEN1LMNAKMT2A
SCHEMBL27999927 0.79 L3MBTL1 (0.56) L3MBTL1MAPK1MEN1LMNAKMT2A
SCHEMBL7716853 0.78 L3MBTL1 (0.53) L3MBTL1MAPK1MEN1LMNAKMT2A
Hydrochloric Acid SCHEMBL28000151 0.78 L3MBTL1 (0.55) L3MBTL1MAPK1MEN1LMNAKMT2A
SCHEMBL19712968 0.76 TDP1 (0.62) L3MBTL1MAPK1MEN1LMNAKMT2A
SCHEMBL16528580 0.75 DDR1 (0.63) L3MBTL1MAPK1MEN1LMNAKMT2A
SCHEMBL3784717 0.74 PDE7A (0.59) L3MBTL1MAPK1MEN1KMT2AALDH1A1

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-2011121602-A1 PROCESS FOR PREPARATION OF DIBENZOTHIAZEPINONE COMPOUNDS HIKAL LIMITED (IN) 2011-10-06 — — WO disclosed
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