SCHEMBL27759405

SCHEMBL27759405

O=C1[CH]c2ccccc2N1c1ccsc1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 1/20 0.34
EGLN1 Q9GZT9 1/20 0.33
NR1H2 P55055 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
HCAR1 Q9BXC0 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MGLL Q99685 5/20 0.30

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
SCHEMBL27759408 0.78 MGLL (0.50) TLR9PKMALDH1A1MGLL
SCHEMBL8980795 0.73 KMT2A (0.50) RAB9A
SCHEMBL28090496 0.70 MGLL (0.54) PKMALDH1A1MAPK1MGLL
SCHEMBL915633 0.70 CES1 (0.64) ALDH1A1
SCHEMBL2342931 0.69 HPGD (0.65) TLR9EGLN1MAPTPKM
SCHEMBL8314729 0.68 CES1 (0.44) EGLN1NR1H2NPC1MAPTPKM
SCHEMBL27967962 0.67 P2RX4 (0.40) EGLN1NPC1MAPTPKMRAB9A
SCHEMBL24462527 0.64 EGLN1 (0.41) EGLN1NPC1MAPTRAB9AALDH1A1
SCHEMBL17047745 0.63 PARP1 (0.40) NPC1MAPTPKMRAB9AHCAR1
SCHEMBL7671094 0.63 MAPT (0.56) NPC1MAPTPKMRAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101378750-B Indolone compounds useful to treat cognitive impairment HELICON THERAPEUTICS INC 2012-07-18 CN disclosed
CN-101378750-A Indolone compounds useful to treat cognitive impairment HELICON THERAPEUTICS INC (US) 2009-03-04 CN disclosed