SCHEMBL6625834

SCHEMBL6625834

Brc1ccc(-c2c[nH]c(SC[C]3C=CC=CN3)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MGAM O43451 9/20 0.34
▸ GAA P10253 9/20 0.34
▸ SI P14410 9/20 0.34
▸ MGAM2 Q2M2H8 9/20 0.34
▸ HSD17B10 Q99714 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ METAP2 P50579 1/20 0.31

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
SCHEMBL6628176 0.87 KMT2A (0.35) GAALMNAHPGDTSHR
SCHEMBL6625835 0.68 GAA (0.33) MGAMGAASIMGAM2HSD17B10
SCHEMBL6629853 0.64 HTT (0.50) HPGDTSHR
SCHEMBL24484639 0.63 RAB9A (0.47) GAALMNAHPGDMETAP2
SCHEMBL855275 0.63 METAP2 (0.38) MGAMGAASIMGAM2LMNA
SCHEMBL5924343 0.60 MAPT (0.47) GAAMETAP2
SCHEMBL28957521 0.60 METAP2 (0.41) GAALMNAMETAP2
SCHEMBL18829052 0.60 METAP2 (0.38) MGAMGAASIMGAM2LMNA
SCHEMBL2617474 0.60 NPC1 (0.40) GAALMNAMETAP2
SCHEMBL6628026 0.59 LMNA (0.52) MGAMGAASIMGAM2LMNA

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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