SCHEMBL27829133

SCHEMBL27829133

c1csc(-c2nc3ccccc3o2)c1.c1csc(-c2nc3ccccc3o2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.65
▸ HSD17B10 Q99714 7/20 0.65
▸ NPC1 O15118 6/20 0.65
▸ RAB9A P51151 5/20 0.65
▸ TP53 P04637 4/20 0.65
▸ MAPT P10636 2/20 0.65
▸ GFER P55789 1/20 0.65
▸ ALDH1A1 P00352 9/20 0.62
▸ HPGD P15428 5/20 0.62
▸ MEN1 O00255 5/20 0.62
▸ KMT2A Q03164 5/20 0.62
▸ SMN1; SMN2 Q16637 3/20 0.62
▸ F2 P00734 1/20 0.62
▸ GPR119 Q8TDV5 3/20 0.50
▸ CYP1A2 P05177 2/20 0.50
▸ CYP2C19 P33261 2/20 0.50
▸ HCRTR1 O43613 1/20 0.50
▸ PKM P14618 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ HSPD1 P10809 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
SCHEMBL1129179 1.00 KDM4E (0.65) KDM4EHSD17B10NPC1RAB9ATP53
SCHEMBL25027923 0.84 KDM4E (0.71) KDM4EHSD17B10NPC1RAB9ATP53
SCHEMBL29531707 0.80 NPC1 (0.69) KDM4EHSD17B10NPC1RAB9ATP53
SCHEMBL824375 0.80 NPC1 (0.69) KDM4EHSD17B10NPC1RAB9ATP53
SCHEMBL39752 0.79 NPC1 (0.55) KDM4EHSD17B10NPC1RAB9ATP53
SCHEMBL29392124 0.79 NPC1 (0.55) KDM4EHSD17B10NPC1RAB9ATP53
SCHEMBL12501435 0.79 KDM4E (0.78) KDM4EHSD17B10NPC1RAB9ATP53
SCHEMBL30851241 0.79 KDM4E (0.69) KDM4EHSD17B10NPC1RAB9ATP53
SCHEMBL2245749 0.79 KDM4E (0.69) KDM4EHSD17B10NPC1RAB9ATP53
SCHEMBL915809 0.78 ALDH1A1 (0.61) KDM4EHSD17B10NPC1RAB9ATP53

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
CN-101056942-B Flame retardant thermoplastic polycarbonate compositions, use thereof and method of its manufacture GEN ELECTRIC 2011-03-23 — — CN disclosed
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