SCHEMBL18229474

SCHEMBL18229474

CNc1ccc(C(=O)NO)cc1N

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.69
HDAC6 Q9UBN7 10/20 0.54
HDAC1 Q13547 7/20 0.54
HDAC8 Q9BY41 4/20 0.50
HDAC2 Q92769 1/20 0.50
KDM4E B2RXH2 3/20 0.46
GAA P10253 3/20 0.46
MAPT P10636 3/20 0.46
ALDH1A1 P00352 2/20 0.46
THRB P10828 2/20 0.46
HPGD P15428 2/20 0.46
GFER P55789 2/20 0.46
HTT P42858 1/20 0.46
PLEC Q15149 1/20 0.46
PTGER4 P35408 1/20 0.44
NPC1 O15118 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GLA P06280 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RCE1 Q9Y256 1/20 0.43

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
SCHEMBL2248152 0.87 PRKCI (0.71) PRKCIHDAC6HDAC1HDAC8HDAC2
SCHEMBL2245773 0.81 PRKCI (1.00) PRKCIHDAC1HDAC2KDM4EGAA
SCHEMBL1270367 0.81 PRKCI (0.73) PRKCIHDAC1KDM4EGAAMAPT
SCHEMBL1067119 0.81 PRKCI (0.73) PRKCIKDM4EGAAMAPTALDH1A1
SCHEMBL7968402 0.81 PRKCI (0.63) PRKCIKDM4EGAAMAPTALDH1A1
Hydrochloric Acid SCHEMBL18691959 0.80 PRKCI (0.71) PRKCIKDM4EGAAMAPTALDH1A1
SCHEMBL18833886 0.80 PRKCI (0.71) PRKCIHDAC1KDM4EGAAMAPT
SCHEMBL1964851 0.80 TP53 (0.56) PRKCIHDAC1HDAC2MAPTNPC1
SCHEMBL2945096 0.79 HDAC6 (0.69) HDAC6HDAC1HDAC8HDAC2KDM4E
SCHEMBL542066 0.79 PRKCI (0.69) PRKCIKDM4EGAAMAPTALDH1A1

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 6 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 disclosed
US-20180110755-A1 BENZIMIDAZOLE DERIVATES USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY KANCERA AB (SE) 2018-04-26 US disclosed
US-20180110755-A1 BENZIMIDAZOLE DERIVATES USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY KANCERA AB (SE) 2018-04-26 US disclosed
EP-3294715-A1 BENZIMIDAZOLE DERIVATES USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY Kancera AB (SE) 2018-03-21 EP disclosed
WO-2016180472-A1 BENZIMIDAZOLE DERIVATES USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY KANCERA AB (SE) 2016-11-17 WO disclosed
WO-2016180472-A1 BENZIMIDAZOLE DERIVATES USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY KANCERA AB (SE) 2016-11-17 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-20180110755-A1 BENZIMIDAZOLE DERIVATES USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY HDAC6, HDAC1, HDAC11 PRKCI 1809/4885HDAC6 1/4885HDAC1 2/4885

“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.