SCHEMBL16499494

SCHEMBL16499494

Cc1cc2c(cc1Cl)C(=O)[C@H]1C(C)(C)CCC[C@@]21C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SOD1 P00441 1/20 0.32
▸ EP300 Q09472 1/20 0.30
▸ NR3C1 P04150 1/20 0.30
▸ PGR P06401 1/20 0.30
▸ NR3C2 P08235 1/20 0.30
▸ AR P10275 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
SCHEMBL12825557 1.00 SOD1 (0.32) SOD1EP300NR3C1PGRNR3C2
SCHEMBL12821421 0.88 SOD1 (0.34) SOD1EP300NR3C1PGRNR3C2
SCHEMBL16499253 0.85 SOD1 (0.32) SOD1EP300
SCHEMBL16499551 0.78 MEN1 (0.33) SOD1
SCHEMBL12825604 0.78 ACHE (0.37) SOD1EP300PGR
SCHEMBL12821396 0.75 ACHE (0.35) SOD1EP300PGRAR
SCHEMBL16499584 0.75 ACHE (0.35) SOD1EP300PGRAR
SCHEMBL16499573 0.74 OPRM1 (0.45) —
SCHEMBL12825588 0.73 ACHE (0.44) SOD1EP300
SCHEMBL12825590 0.72 EP300 (0.30) EP300

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
WO-2011155983-A1 OPSIN-BINDING LIGANDS, COMPOSITIONS AND METHODS OF USE BIKAM PHARMACEUTICALS INC. (US) 2011-12-15 — — WO disclosed
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