SCHEMBL8611734

SCHEMBL8611734

Cc1coc(C(C)(O)c2ccsc2)n1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 1/20 0.32
DRD2 P14416 1/20 0.31
HTR6 P50406 1/20 0.31
KDM4E B2RXH2 1/20 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
SCHEMBL8614900 0.70 KDM4E (0.30) KDM4E
SCHEMBL8682436 0.70 KCNH2 (0.32)
SCHEMBL8615946 0.70 RORC (0.36) KDM4E
SCHEMBL8613466 0.70 KDM4E (0.30) KDM4E
SCHEMBL29226461 0.70 RAB9A (0.36)
SCHEMBL29226464 0.70 RAB9A (0.36)
SCHEMBL8613461 0.68 SRC (0.33)
SCHEMBL8616835 0.67 KDM4E (0.34) KDM4E
SCHEMBL8612881 0.67 AR (0.36) CHRM3
SCHEMBL8617512 0.67 MLYCD (0.38) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5731335-A NERVOUS SYSTEM DISORDERS; STROKE; ANTIISCHEMIC AGENTS; COGNITION ACTIVATORS ASTRA AKTIEBOLAG (SE) 1998-03-24 US claimed
CN-1126994-A Novel (1-heteroazolyl-1-heterocyclyl) alkane derivatives and their use as neuroprotective agents ASTRA AB (SE) 1996-07-17 CN claimed
EP-0707584-A1 NOVEL (1-HETEROAZOLYL-1-HETEROCYCLYL)ALKANE DERIVATIVES AND THEIR USE AS NEUROPROTECTIVE AGENTS Astra Aktiebolag (SE) 1996-04-24 EP claimed
WO-1995001979-A1 NOVEL (1-HETEROAZOLYL-1-HETEROCYCLYL)ALKANE DERIVATIVES AND THEIR USE AS NEUROPROTECTIVE AGENTS ASTRA AKTIEBOLAG (SE) 1995-01-19 WO claimed
US-5731335-A NERVOUS SYSTEM DISORDERS; STROKE; ANTIISCHEMIC AGENTS; COGNITION ACTIVATORS ASTRA AKTIEBOLAG (SE) 1998-03-24 US disclosed
US-5607956-A TREATMENT OF NEURODEGENERATIVE DISORDERS SUCH AS CEREBRAL ISCHEMIA, ALZHEIMER'S DISEASE ASTRA AKTIEBOLAG (SE) 1997-03-04 US disclosed
CN-1126994-A Novel (1-heteroazolyl-1-heterocyclyl) alkane derivatives and their use as neuroprotective agents ASTRA AB (SE) 1996-07-17 CN disclosed
EP-0707584-A1 NOVEL (1-HETEROAZOLYL-1-HETEROCYCLYL)ALKANE DERIVATIVES AND THEIR USE AS NEUROPROTECTIVE AGENTS Astra Aktiebolag (SE) 1996-04-24 EP disclosed
WO-1995001979-A1 NOVEL (1-HETEROAZOLYL-1-HETEROCYCLYL)ALKANE DERIVATIVES AND THEIR USE AS NEUROPROTECTIVE AGENTS ASTRA AKTIEBOLAG (SE) 1995-01-19 WO disclosed