SCHEMBL2076609

SCHEMBL2076609

CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1ccc(-c2ncc(C=O)cc2C#N)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 11/20 0.48
KCNH2 Q12809 1/20 0.46
TRPV1 Q8NER1 2/20 0.43
LMNA P02545 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
TTK P33981 1/20 0.39
NAMPT P43490 1/20 0.38
NTRK1 P04629 1/20 0.36
EGLN2 Q96KS0 1/20 0.36
AR P10275 1/20 0.36

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
SCHEMBL12772655 0.87 HDAC1 (0.54) HDAC1KCNH2TRPV1LMNACYP1A2
SCHEMBL5315917 0.87 HDAC1 (0.47) HDAC1TRPV1NAMPTNTRK1
SCHEMBL2076222 0.83 HDAC1 (0.67) HDAC1TRPV1TTKNAMPT
SCHEMBL12772653 0.82 HDAC1 (0.49) HDAC1KCNH2TRPV1LMNACYP1A2
SCHEMBL12772660 0.81 HDAC1 (0.49) HDAC1KCNH2TRPV1LMNACYP1A2
SCHEMBL12772580 0.81 HDAC1 (0.70) HDAC1KCNH2
SCHEMBL12772662 0.80 HDAC1 (0.49) HDAC1KCNH2TRPV1
SCHEMBL2077264 0.78 ALDH1A1 (0.44) HDAC1TRPV1CYP1A2TTKNAMPT
SCHEMBL1065454 0.78 F10 (0.49) HDAC1NAMPT
SCHEMBL1064751 0.76 HDAC1 (0.53) HDAC1LMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7897778-B2 Benzamide compounds ASTRAZENECA (SE) 2011-03-01 US disclosed
US-20080293687-A1 Benzamide Compounds ASTRAZENECA AB (SE) 2008-11-27 US disclosed
WO-2006024841-A2 BENZAMIDE COMPOUNDS ASTRAZENECA AB (SE) 2006-03-09 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-20080293687-A1 Benzamide Compounds HDAC1, HDAC11, HDAC2 HDAC1 1/4885KCNH2 1027/4885TRPV1 1257/4885

“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.