SCHEMBL8796347

SCHEMBL8796347

CC(C)(C)[Si](C)(C)Oc1cc(I)ccc1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RARA P10276 3/20 0.31
RARB P10826 3/20 0.31
RARG P13631 3/20 0.31
MEN1 O00255 1/20 0.31
NR1I2 O75469 1/20 0.31
LMNA P02545 1/20 0.31
PGR P06401 1/20 0.31
HSPD1 P10809 1/20 0.31
GOT1 P17174 1/20 0.31
GLRA1 P23415 1/20 0.31
BLM P54132 1/20 0.31
HSPE1 P61604 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
IDO1 P14902 1/20 0.31
TDO2 P48775 1/20 0.31
CXCR3 P49682 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
SCHEMBL3313281 0.85 HDAC11 (0.32) RARARARBRARGMEN1NR1I2
SCHEMBL13330393 0.82 HTT (0.35) MEN1KMT2A
SCHEMBL8398381 0.81 RARB (0.37) RARARARBRARGMEN1NR1I2
SCHEMBL8796037 0.80 RARA (0.42) RARARARBRARGMEN1NR1I2
SCHEMBL404791 0.78 HDAC11 (0.36) RARARARBRARGMEN1NR1I2
SCHEMBL13330446 0.76 CNR2 (0.32) RARARARBRARGMEN1NR1I2
SCHEMBL3313383 0.75 RARA (0.34) RARARARBRARGMEN1NR1I2
SCHEMBL8796348 0.75 SCN9A (0.30)
SCHEMBL8910587 0.75
SCHEMBL5828203 0.74 RARA (0.35) RARARARBRARGMEN1NR1I2

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
EP-0629604-B1 Alicyclic phospholipase A2 inhibitors BRISTOL MYERS SQUIBB CO (US) 1997-04-16 EP disclosed
US-5436369-A Alicyclic phospholipase A2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 1995-07-25 US disclosed
EP-0629604-A2 Alicyclic phospholipase A2 inhibitors Bristol-Myers Company (US) 1994-12-21 EP disclosed