SCHEMBL18229641

SCHEMBL18229641

Cc1ccc(-c2nc3ccc(C(=O)NO)cc3[nH]2)c(C)c1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 18/20 0.65
HDAC3 O15379 9/20 0.65
HDAC7 Q8WUI4 2/20 0.65
HDAC9 Q9UKV0 1/20 0.65
HDAC1 Q13547 7/20 0.62
HDAC8 Q9BY41 7/20 0.62
HDAC2 Q92769 5/20 0.62
HDAC10 Q969S8 1/20 0.58
NPBWR1 P48145 1/20 0.57
F2 P00734 1/20 0.54
F10 P00742 1/20 0.54
PLG P00747 1/20 0.54
PLAU P00749 1/20 0.54
PLAT P00750 1/20 0.54
PRSS1 P07477 1/20 0.54

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
SCHEMBL18229696 0.90 HDAC6 (0.65) HDAC6HDAC3HDAC7HDAC9HDAC1
SCHEMBL20088852 0.89 HDAC6 (0.74) HDAC6HDAC3HDAC7HDAC9HDAC1
SCHEMBL20088905 0.86 HDAC6 (0.74) HDAC6HDAC3HDAC7HDAC9HDAC1
SCHEMBL18229669 0.84 HDAC6 (0.79) HDAC6HDAC3HDAC7HDAC9HDAC1
SCHEMBL18229681 0.82 HDAC6 (0.67) HDAC6HDAC3HDAC7HDAC9HDAC1
SCHEMBL18237041 0.81 HDAC6 (0.76) HDAC6HDAC3HDAC7HDAC9HDAC1
SCHEMBL18229629 0.79 HDAC6 (1.00) HDAC6HDAC3HDAC7HDAC9HDAC1
SCHEMBL18229505 0.79 HDAC6 (0.71) HDAC6HDAC3HDAC7HDAC9HDAC1
SCHEMBL18229732 0.78 HDAC6 (0.77) HDAC6HDAC3HDAC7HDAC9HDAC1
SCHEMBL18229701 0.78 HDAC6 (0.69) HDAC6HDAC3HDAC7HDAC9HDAC1

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-3294715-B1 BENZIMIDAZOLE DERIVATES USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY KANCERA AB (SE) 2020-05-06 EP claimed
EP-3294715-A1 BENZIMIDAZOLE DERIVATES USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY Kancera AB (SE) 2018-03-21 EP claimed
WO-2016180472-A1 BENZIMIDAZOLE DERIVATES USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY KANCERA AB (SE) 2016-11-17 WO claimed
EP-3294715-B1 BENZIMIDAZOLE DERIVATES USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY KANCERA AB (SE) 2020-05-06 EP disclosed
US-20180110755-A1 BENZIMIDAZOLE DERIVATES USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY KANCERA AB (SE) 2018-04-26 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-20180110755-A1 BENZIMIDAZOLE DERIVATES USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY HDAC6, HDAC1, HDAC11 HDAC6 1/4885HDAC3 11/4885HDAC7 5/4885

“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.