SCHEMBL8614196

SCHEMBL8614196

Cc1nc(C(O)(c2ccsc2)C(F)(F)F)sc1C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GRM5 P41594 1/20 0.31
JAK2 O60674 1/20 0.30
EGFR P00533 1/20 0.30
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
SCHEMBL8681899 0.82 NOS1 (0.37)
SCHEMBL8681915 0.73 NOS1 (0.38)
SCHEMBL13841474 0.66 NOS1 (0.42) ALDH1A1SMN1; SMN2
SCHEMBL8613461 0.65 SRC (0.33)
SCHEMBL8682786 0.65 NOS1 (0.41) ALDH1A1SMN1; SMN2
SCHEMBL12179226 0.65 NOS1 (0.41) ALDH1A1SMN1; SMN2
SCHEMBL12759665 0.65 NR1H2 (0.43) SMN1; SMN2
SCHEMBL8616835 0.64 KDM4E (0.34) KDM4E
SCHEMBL2975836 0.62
SCHEMBL827480 0.61

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 3 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 disclosed
US-5607956-A TREATMENT OF NEURODEGENERATIVE DISORDERS SUCH AS CEREBRAL ISCHEMIA, ALZHEIMER'S DISEASE ASTRA AKTIEBOLAG (SE) 1997-03-04 US 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