SCHEMBL3289754

SCHEMBL3289754

O=C(/C=C/c1ccc(-c2ccc(O)c(C34CC5CC(CC(C5)C3)C4)c2)c(Cl)c1)NO

nearest known ligand 0.80

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 10/20 0.80
NR0B2 Q15466 3/20 0.80
HDAC11 Q96DB2 4/20 0.77
HDAC7 Q8WUI4 3/20 0.77
HDAC8 Q9BY41 3/20 0.77
HDAC6 Q9UBN7 3/20 0.77
HDAC2 Q92769 3/20 0.77
HDAC4 P56524 2/20 0.77
HDAC9 Q9UKV0 2/20 0.77
HDAC3 O15379 1/20 0.77
HDAC5 Q9UQL6 1/20 0.77
HDAC1 Q13547 2/20 0.73
HDAC10 Q969S8 1/20 0.73
RARB P10826 4/20 0.62
PTPRCAP Q14761 2/20 0.60
RARA P10276 1/20 0.52
RARG P13631 1/20 0.52

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
SCHEMBL3289761 1.00 PTPN11 (0.80) PTPN11NR0B2HDAC11HDAC7HDAC8
SCHEMBL29604865 0.89 PTPN11 (1.00) PTPN11NR0B2HDAC11HDAC7HDAC8
SCHEMBL1914215 0.89 PTPN11 (1.00) PTPN11NR0B2HDAC11HDAC7HDAC8
SCHEMBL1914213 0.89 PTPN11 (1.00) PTPN11NR0B2HDAC11HDAC7HDAC8
SCHEMBL12257833 0.88 PTPN11 (0.83) PTPN11NR0B2HDAC11HDAC7HDAC8
SCHEMBL3295460 0.87 HDAC2 (1.00) PTPN11NR0B2HDAC11HDAC7HDAC8
SCHEMBL3295457 0.87 HDAC2 (1.00) PTPN11NR0B2HDAC11HDAC7HDAC8
SCHEMBL2391090 0.83 PTPN11 (0.74) PTPN11NR0B2HDAC11HDAC7HDAC8
SCHEMBL13310490 0.80 HDAC8 (0.53) PTPN11NR0B2HDAC11HDAC7HDAC8
SCHEMBL2407028 0.78 PTPN11 (0.77) PTPN11NR0B2HDAC11HDAC7HDAC8

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
EP-1896399-B1 BIPHENYL AND NAPHTHYL-PHENYL HYDROXAMIC ACID DERIVATIVES SIGMA TAU IND FARMACEUTI (IT) 2010-11-17 EP claimed
US-7728039-B2 Biphenyl and Naphthyl-Phenyl Hydroxamic Acid Derivatives SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2010-06-01 US claimed
US-20080319082-A1 Biphenyl and Naphthyl-Phenyl Hydroxamic Acid Derivatives SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2008-12-25 US claimed
EP-1896399-B1 BIPHENYL AND NAPHTHYL-PHENYL HYDROXAMIC ACID DERIVATIVES SIGMA TAU IND FARMACEUTI (IT) 2010-11-17 EP disclosed
US-7728039-B2 Biphenyl and Naphthyl-Phenyl Hydroxamic Acid Derivatives SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2010-06-01 US disclosed
US-7728039-B2 Biphenyl and Naphthyl-Phenyl Hydroxamic Acid Derivatives SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2010-06-01 US disclosed
US-20080319082-A1 Biphenyl and Naphthyl-Phenyl Hydroxamic Acid Derivatives SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2008-12-25 US disclosed
US-20080319082-A1 Biphenyl and Naphthyl-Phenyl Hydroxamic Acid Derivatives SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2008-12-25 US disclosed
EP-1896399-A1 BIPHENYL AND NAPHTHYL-PHENYL HYDROXAMIC ACID DERIVATIVES SIGMA-TAU Industrie Farmaceutiche Riunite S.p.A. (IT) 2008-03-12 EP disclosed
WO-2007000383-A1 BIPHENYL AND NAPHTHYL-PHENYL HYDROXAMIC ACID DERIVATIVES SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2007-01-04 WO 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-20080319082-A1 Biphenyl and Naphthyl-Phenyl Hydroxamic Acid Derivatives VHL, ARNT, AHR PTPN11 2111/4885NR0B2 97/4885HDAC11 104/4885

“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.