SCHEMBL1616205

SCHEMBL1616205

COC(=O)c1ccc(CNC(=O)C(F)(F)c2ccc3c(c2)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.51
CYP26A1 O43174 5/20 0.47
RXRA P19793 5/20 0.45
RXRB P28702 4/20 0.45
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
RXRG P48443 3/20 0.43
CYP26B1 Q9NR63 2/20 0.43
EPHX2 P34913 2/20 0.42
NR1H4 Q96RI1 2/20 0.42
GAA P10253 1/20 0.41
CYP2C19 P33261 1/20 0.41
RARB P10826 2/20 0.40
RARG P13631 2/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL1615109 0.88 HDAC6 (0.52) CYP3A4CYP26A1RXRARXRBRXRG
SCHEMBL1615798 0.84 CYP3A4 (0.51) CYP3A4CYP26A1RXRARXRBRXRG
SCHEMBL8839355 0.81 CYP3A4 (0.61) CYP3A4CYP26A1RXRARXRBRXRG
SCHEMBL1616060 0.77 RAB9A (0.48) CYP3A4CYP26A1RXRARXRBEPHX2
SCHEMBL8677671 0.76 CYP3A4 (0.61) CYP3A4CYP26A1RXRARXRBCA1
SCHEMBL1616240 0.76 CYP26A1 (0.55) CYP3A4CYP26A1RXRARXRBCA1
SCHEMBL1616264 0.75 RXRA (0.51) CYP3A4CYP26A1RXRARXRBRXRG
SCHEMBL7422927 0.74 RXRA (0.70) CYP3A4CYP26A1RXRARXRBRXRG
SCHEMBL6148258 0.73 CYP3A4 (0.64) CYP3A4CYP26A1RXRARXRBRXRG
SCHEMBL8072288 0.73 LOXL2 (0.53) CA1CA2EPHX2NR1H4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7923579-B2 Tricyclic hydroxamate and benzamide derivatives, compositions and methods EXONHIT THERAPEUTICS S.A. (FR) 2011-04-12 US disclosed
US-7923579-B2 Tricyclic hydroxamate and benzamide derivatives, compositions and methods EXONHIT THERAPEUTICS S.A. (FR) 2011-04-12 US disclosed
US-7923579-B2 Tricyclic hydroxamate and benzamide derivatives, compositions and methods EXONHIT THERAPEUTICS S.A. (FR) 2011-04-12 US disclosed
EP-1692097-B1 TRICYCLIC HYDROXAMATE AND BENZAMIDE DERIVATIVES, COMPOSITIONS AND METHODS EXONHIT THERAPEUTICS SA (FR) 2009-09-02 EP disclosed
EP-1692097-B1 TRICYCLIC HYDROXAMATE AND BENZAMIDE DERIVATIVES, COMPOSITIONS AND METHODS EXONHIT THERAPEUTICS SA (FR) 2009-09-02 EP disclosed
US-20070129368-A1 Tricyclic hydroxamate and benzamide derivatives, compositions and methods EXONHIT THERAPEUTICS S.A. (FR) 2007-06-07 US disclosed
US-20070129368-A1 Tricyclic hydroxamate and benzamide derivatives, compositions and methods EXONHIT THERAPEUTICS S.A. (FR) 2007-06-07 US disclosed
US-20070129368-A1 Tricyclic hydroxamate and benzamide derivatives, compositions and methods EXONHIT THERAPEUTICS S.A. (FR) 2007-06-07 US disclosed
WO-2005058803-A1 TRICYCLIC HYDROXAMATE AND BENZAMIDE DERIVATIVES, COMPOSITIONS AND METHODS EXONHIT THERAPEUTICS SA (FR) 2005-06-30 WO disclosed
EP-1541549-A1 Tricyclic hydroxamate and benzaminde derivatives, compositions and methods Exonhit Therapeutics S.A. (FR) 2005-06-15 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070129368-A1 Tricyclic hydroxamate and benzamide derivatives, compositions and methods HDAC5, HDAC1, HDAC2 CYP3A4 1996/4885CYP26A1 1813/4885RXRA 1796/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.