SCHEMBL6027259

SCHEMBL6027259

COC(=O)c1ccccc1CNC(=O)C(=O)Nc1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.46
CYP26A1 O43174 6/20 0.44
KMT2A Q03164 6/20 0.44
CYP3A4 P08684 5/20 0.44
RARA P10276 4/20 0.44
RARB P10826 4/20 0.44
RARG P13631 4/20 0.44
MEN1 O00255 4/20 0.44
PGR P06401 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
TBXA2R P21731 1/20 0.44
BLVRB P30043 1/20 0.44
CYP26B1 Q9NR63 2/20 0.43
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
GAA P10253 1/20 0.40
TSHR P16473 2/20 0.39
MAPK1 P28482 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL1616240 0.81 CYP26A1 (0.55) CYP26A1KMT2ACYP3A4RARARARB
SCHEMBL1615594 0.77 CYP26A1 (0.60) CYP26A1KMT2ACYP3A4RARARARB
SCHEMBL1614827 0.74 CYP26A1 (0.58) CYP26A1KMT2ACYP3A4RARARARB
SCHEMBL1616029 0.72 CYP26A1 (0.60) CYP26A1KMT2ACYP3A4RARARARB
SCHEMBL1615912 0.71 RARB (0.65) CYP26A1KMT2ACYP3A4RARARARB
SCHEMBL8839196 0.70 SMN1; SMN2 (0.51) CYP26A1KMT2ACYP3A4RARARARB
SCHEMBL10459708 0.69 RXRA (0.56) CYP26A1KMT2ACYP3A4RARARARB
SCHEMBL8165528 0.69 PDE4B (0.43) CYP26A1KMT2ACYP3A4RARARARB
SCHEMBL9446451 0.69 RARA (0.60) CYP26A1KMT2ACYP3A4RARARARB
SCHEMBL7896396 0.68 RXRA (0.58) CYP26A1KMT2ACYP3A4RARARARB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1692097-A1 TRICYCLIC HYDROXAMATE AND BENZAMIDE DERIVATIVES, COMPOSITIONS AND METHODS Exonhit Therapeutics SA (FR) 2006-08-23 EP disclosed
WO-2005058803-A1 TRICYCLIC HYDROXAMATE AND BENZAMIDE DERIVATIVES, COMPOSITIONS AND METHODS EXONHIT THERAPEUTICS SA (FR) 2005-06-30 WO disclosed