SCHEMBL8977358

SCHEMBL8977358

Fc1cc(-n2cccc2)c2nc(S)[nH]c2c1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.32
GRIA1 P42261 1/20 0.32
GRIA2 P42262 1/20 0.32
GRIA3 P42263 1/20 0.32
GRIA4 P48058 1/20 0.32

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
SCHEMBL8977366 0.75 CYP19A1 (0.35) CYP19A1
SCHEMBL2105970 0.74 EGLN1 (0.41)
SCHEMBL8977368 0.72 OPRL1 (0.37) CYP19A1GRIA1GRIA2GRIA3GRIA4
SCHEMBL8977372 0.72 GRIA1 (0.35) CYP19A1GRIA1GRIA2GRIA3GRIA4
SCHEMBL17702677 0.66 PARP1 (0.41)
SCHEMBL1253211 0.61 MAPT (0.34)
SCHEMBL1253213 0.61 CBFB (0.42)
SCHEMBL8682741 0.60 GAA (0.42)
SCHEMBL2106084 0.60 ALPL (0.56)
SCHEMBL29475261 0.57 CYP19A1 (0.31) CYP19A1

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
US-5554631-A ANTIULCER IL-YANG PHARM. CO., LTD. (KR) 1996-09-10 US disclosed