SCHEMBL3292447

SCHEMBL3292447

COc1ccc(-c2ccccc2)c(/C=C/C(=O)O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 4/20 0.60
▸ HDAC3 O15379 1/20 0.57
▸ HDAC1 Q13547 1/20 0.57
▸ NCOR2 Q9Y618 1/20 0.57
▸ GAA P10253 1/20 0.56
▸ THRB P10828 1/20 0.51
▸ ATM Q13315 1/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ JUN P05412 1/20 0.50
▸ NFKB1 P19838 1/20 0.50
▸ LTB4R Q15722 1/20 0.49
▸ LTB4R2 Q9NPC1 1/20 0.49
▸ PTGER4 P35408 1/20 0.49
▸ PTGER3 P43115 1/20 0.49
▸ PTGER2 P43116 1/20 0.49
▸ BACE1 P56817 2/20 0.48

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
SCHEMBL3292450 1.00 HDAC8 (0.60) HDAC8HDAC3HDAC1NCOR2GAA
SCHEMBL3295963 0.89 HDAC8 (0.61) HDAC8HDAC3HDAC1NCOR2SMN1; SMN2
SCHEMBL3295959 0.89 HDAC8 (0.61) HDAC8HDAC3HDAC1NCOR2SMN1; SMN2
SCHEMBL5993526 0.88 HDAC8 (0.76) HDAC8HDAC3HDAC1NCOR2GAA
SCHEMBL5993525 0.88 HDAC8 (0.76) HDAC8HDAC3HDAC1NCOR2GAA
SCHEMBL3292153 0.86 HDAC8 (0.81) HDAC8HDAC3HDAC1NCOR2
SCHEMBL3292152 0.86 HDAC8 (0.81) HDAC8HDAC3HDAC1NCOR2
SCHEMBL19257268 0.83 HDAC8 (0.45) HDAC8HDAC3HDAC1NCOR2GAA
SCHEMBL19257224 0.82 HDAC8 (0.44) HDAC8HDAC3HDAC1NCOR2GAA
SCHEMBL19257274 0.82 HDAC8 (0.44) HDAC8HDAC3HDAC1NCOR2GAA

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 5 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 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
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 HDAC8 101/4885HDAC3 50/4885HDAC1 59/4885

“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.

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