SCHEMBL1818640

SCHEMBL1818640

CC(Oc1ccccc1)(C(=O)NO)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 2/20 0.58
HDAC4 P56524 2/20 0.58
HDAC1 Q13547 2/20 0.58
HDAC7 Q8WUI4 2/20 0.58
HDAC2 Q92769 2/20 0.58
HDAC10 Q969S8 2/20 0.58
HDAC11 Q96DB2 2/20 0.58
HDAC8 Q9BY41 2/20 0.58
HDAC6 Q9UBN7 2/20 0.58
HDAC9 Q9UKV0 2/20 0.58
HDAC5 Q9UQL6 2/20 0.58
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
MMP2 P08253 5/20 0.43
MMP13 P45452 5/20 0.43
MMP1 P03956 3/20 0.43
KCNN4 O15554 1/20 0.42
MMP8 P22894 1/20 0.41
NPC1 O15118 1/20 0.39
POLB P06746 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
SCHEMBL1819039 0.86 PPARA (0.46) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1821867 0.85 PPARA (0.45) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1823516 0.85 PPARA (0.45) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1821618 0.83 PPARA (0.44) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1818707 0.83 PPARA (0.47) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1819711 0.82 PPARA (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1817762 0.82 PPARG (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1819564 0.82 PPARG (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL5691818 0.82 PPARG (0.61) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1821781 0.81 PPARA (0.42) HDAC3HDAC4HDAC1HDAC7HDAC2

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
US-7947712-B2 Antiarthritic agents; asthma; chronic obstructive pulminary diosrders; atherosclerosis; vision defects; hepatitis; central nervous system disorders; cardiovascular disorders; wound healing agents; restenosis; cirrhosis; multiple sclerosis; glomerulonephritis; graft versus host disease; antidiabetic agent WYETH LLC (US) 2011-05-24 US disclosed
US-20080269213-A1 8-Hydroxyquinoline compounds and methods thereof WYETH (US) 2008-10-30 US 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-20080269213-A1 8-Hydroxyquinoline compounds and methods thereof MMP8, MMP26, MMP9 HDAC3 1039/4885HDAC4 1091/4885HDAC1 1800/4885

“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.