SCHEMBL15746271

SCHEMBL15746271

Cc1ccc(N)c(NC(=O)C2CCCC2)c1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.67
KMT2A Q03164 1/20 0.67
HDAC1 Q13547 15/20 0.64
HDAC2 Q92769 15/20 0.64
HDAC3 O15379 12/20 0.64
NPSR1 Q6W5P4 2/20 0.56
LMNA P02545 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
SCHEMBL16994747 0.83 KMT2A (0.73) GAAKMT2ANPSR1LMNA
SCHEMBL27645392 0.83 HDAC2 (0.49) GAAKMT2AHDAC1HDAC2HDAC3
SCHEMBL7604703 0.82 HDAC1 (0.63) HDAC1HDAC2HDAC3
SCHEMBL2590028 0.80 HDAC2 (0.51) GAAKMT2AHDAC1HDAC2HDAC3
SCHEMBL13738325 0.79 HDAC1 (1.00) HDAC1HDAC2HDAC3
SCHEMBL29848538 0.78 HDAC1 (0.59) KMT2AHDAC1HDAC2HDAC3LMNA
SCHEMBL25668704 0.78 KMT2A (0.70) GAAKMT2ANPSR1LMNA
SCHEMBL13833695 0.78 HDAC1 (1.00) HDAC1HDAC2HDAC3
SCHEMBL20460484 0.78 KMT2A (0.74) GAAKMT2AHDAC1HDAC2HDAC3
SCHEMBL13833436 0.77 HDAC1 (1.00) HDAC1HDAC2HDAC3

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-9303061-B2 Spiro compounds as Hepatitis C virus inhibitors Sunshine Luke Pharma Co., Ltd. (CN) 2016-04-05 US disclosed
US-20140147412-A1 SPIRO COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2014-05-29 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-20140147412-A1 SPIRO COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS HAVCR2, SORD, SLC10A1 GAA 2237/4885KMT2A 4772/4885HDAC1 1019/4885

“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.