SCHEMBL3034462

SCHEMBL3034462

NC(=O)c1cccc(-c2ccc(C(=O)NO)cc2)c1CCc1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 8/20 0.47
▸ MCHR1 Q99705 3/20 0.46
▸ SMPD1 P17405 2/20 0.43
▸ HDAC6 Q9UBN7 4/20 0.43
▸ HDAC3 O15379 2/20 0.43
▸ NCOR2 Q9Y618 1/20 0.43
▸ HDAC8 Q9BY41 3/20 0.42
▸ HDAC7 Q8WUI4 1/20 0.41
▸ PARP1 P09874 1/20 0.41
▸ PARP2 Q9UGN5 1/20 0.41
▸ HDAC2 Q92769 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ CTDSP1 Q9GZU7 1/20 0.40

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
SCHEMBL3017472 0.89 HDAC1 (0.53) HDAC1HDAC6HDAC3NCOR2HDAC8
SCHEMBL3037600 0.89 HDAC1 (0.47) HDAC1HDAC6HDAC3NCOR2HDAC8
SCHEMBL3029955 0.82 HDAC6 (0.43) HDAC1HDAC6HDAC8ALDH1A1
SCHEMBL3026062 0.81 HDAC1 (0.52) HDAC1HDAC6HDAC3NCOR2HDAC8
SCHEMBL3453784 0.80 HDAC1 (0.47) HDAC1HDAC6HDAC3PARP1HDAC2
SCHEMBL3032639 0.79 HDAC6 (0.44) HDAC1SMPD1HDAC6HDAC3NCOR2
SCHEMBL3035678 0.78 HDAC6 (0.45) HDAC1HDAC6HDAC3NCOR2HDAC8
SCHEMBL3039840 0.74 HDAC8 (0.41) HDAC1HDAC6HDAC3HDAC8HDAC2
SCHEMBL3029944 0.74 HDAC6 (0.44) HDAC1HDAC6HDAC3NCOR2HDAC8
SCHEMBL3024501 0.74 HDAC6 (0.41) HDAC1HDAC6HDAC3NCOR2HDAC8

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-20100216796-A1 N-HYDROXY-NAPHTHALENE DICARBOXAMIDE AND N-HYDROXY-BIPHENYL-DICARBOXAMIDE COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS KATTAR SOLOMON 2010-08-26 — — US claimed
US-20100216796-A1 N-HYDROXY-NAPHTHALENE DICARBOXAMIDE AND N-HYDROXY-BIPHENYL-DICARBOXAMIDE COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS KATTAR SOLOMON 2010-08-26 — — 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-20100216796-A1 N-HYDROXY-NAPHTHALENE DICARBOXAMIDE AND N-HYDROXY-BIPHENYL-DICARBOXAMIDE COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS BRDT, AADAC, ACIN1 HDAC1 5/4885MCHR1 3924/4885SMPD1 1610/4885

“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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