SCHEMBL6628026

SCHEMBL6628026

Clc1ccc(CSc2nc(-c3ccccc3)c[nH]2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ HTT P42858 2/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ MAOB P27338 1/20 0.50
▸ CTSB P07858 1/20 0.50
▸ POLB P06746 2/20 0.49
▸ TDP1 Q9NUW8 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ GAA P10253 2/20 0.46
▸ TP53 P04637 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ MGAM O43451 1/20 0.44
▸ SI P14410 1/20 0.44
▸ MGAM2 Q2M2H8 1/20 0.44
▸ SCN9A Q15858 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ DAO P14920 1/20 0.43

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
SCHEMBL6629853 0.90 HTT (0.50) MEN1KMT2AHTTALDH1A1MAOB
SCHEMBL2872354 0.78 NR1H2 (0.49) LMNAMEN1KMT2AHTTALDH1A1
SCHEMBL3174768 0.75 MAPT (0.62) LMNAMEN1KMT2AALDH1A1POLB
SCHEMBL6482032 0.74 KDM4E (0.51) LMNAALDH1A1L3MBTL1SMN1; SMN2MAPT
SCHEMBL6627174 0.72 HPGD (0.49) MEN1KMT2AHTTALDH1A1POLB
SCHEMBL2868702 0.72 NR1H2 (0.56) KMT2AHTTALDH1A1POLBTDP1
SCHEMBL6627560 0.71 KMT2A (0.45) LMNAMEN1KMT2AHTTALDH1A1
SCHEMBL7451163 0.71 PDE10A (0.44) LMNAMEN1KMT2AHTTGAA
SCHEMBL6628176 0.71 KMT2A (0.35) LMNAMEN1KMT2AHTTALDH1A1
SCHEMBL27814931 0.71 NR1H2 (0.44) HTTALDH1A1TP53SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2004525942-A — — 2004-08-26 — — JP claimed
US-20040116495-A1 Compounds and methods SMITHKLINE BEECHAM CORPORATION 2004-06-17 — — US claimed
EP-1379241-A1 COMPOUNDS AND METHODS SmithKline Beecham Corporation (US) 2004-01-14 — — EP claimed
WO-2002078699-A1 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2002-10-10 — — WO claimed
US-20040116495-A1 Compounds and methods SMITHKLINE BEECHAM CORPORATION 2004-06-17 — — US disclosed
EP-1379241-A1 COMPOUNDS AND METHODS SmithKline Beecham Corporation (US) 2004-01-14 — — EP disclosed
WO-2002078699-A1 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2002-10-10 — — WO disclosed
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