SCHEMBL7683467

SCHEMBL7683467

CC=CCS(=O)(=O)c1cccc(-c2ccc(O[Si](C)(C)C(C)(C)C)c(C34CC5CC(CC(C5)C3)C4)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC11 Q96DB2 4/20 0.36
HDAC2 Q92769 1/20 0.36
RARA P10276 3/20 0.36
RARB P10826 3/20 0.36
RARG P13631 3/20 0.36
MEN1 O00255 1/20 0.36
NR1I2 O75469 1/20 0.36
LMNA P02545 1/20 0.36
PGR P06401 1/20 0.36
HSPD1 P10809 1/20 0.36
GOT1 P17174 1/20 0.36
GLRA1 P23415 1/20 0.36
BLM P54132 1/20 0.36
HSPE1 P61604 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35

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
SCHEMBL7691658 0.87 HDAC11 (0.48) HDAC11HDAC2RARARARBRARG
SCHEMBL8649448 0.80 KMT2A (0.33) RARARARBRARGMEN1NR1I2
SCHEMBL6621729 0.79 HDAC11 (0.39) HDAC11HDAC2RARARARBRARG
SCHEMBL6618558 0.79 HDAC11 (0.42) HDAC11HDAC2RARARARBRARG
SCHEMBL8649454 0.78 HTT (0.32)
SCHEMBL8595749 0.77 HDAC11 (0.37) HDAC11HDAC2RARARARBRARG
SCHEMBL6704746 0.76 FAAH (0.46) HDAC11HDAC2RARARARBRARG
SCHEMBL7683460 0.76 RARA (0.44) HDAC11HDAC2RARARARBRARG
SCHEMBL404472 0.76 HDAC11 (0.49) HDAC11HDAC2RARARARBRARG
SCHEMBL6622319 0.76 RARB (0.39) HDAC11HDAC2RARARARBRARG

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-RE37947-E1 Aromatic polyenic compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2002-12-31 US disclosed
EP-0679628-B1 Polyene derivatives, pharmaceutical and cosmetic composition containing them and their use CIRD GALDERMA (FR) 1998-04-22 EP disclosed
EP-0679628-A1 Polyene derivatives, pharmaceutical and cosmetic composition containing them and their use CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1995-11-02 EP disclosed