SCHEMBL754493

SCHEMBL754493

COCNC(=O)CCN(C(=O)OC(C)(C)C)C1CC1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 1/20 0.32
REN P00797 1/20 0.31
TSHR P16473 1/20 0.30
KDM1A O60341 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL6498594 0.81 CA14 (0.34) CA14RENHDAC6
SCHEMBL755177 0.79 CA14 (0.35) CA14TSHRHDAC6
SCHEMBL21043411 0.78 KMT2A (0.34) CA14KDM1AHDAC8HDAC6
SCHEMBL6497822 0.77 BTK (0.38) CA14HDAC6
SCHEMBL12827200 0.77 L3MBTL1 (0.33) CA14RENKDM1AHDAC8HDAC6
SCHEMBL752843 0.76 CA14 (0.40) CA14HDAC6
SCHEMBL16921539 0.76 HDAC6 (0.36) CA14HDAC6
SCHEMBL6486048 0.76 BTK (0.37)
SCHEMBL2486327 0.75 CA14 (0.42) CA14TSHRHDAC6
SCHEMBL2485879 0.75 CA14 (0.42) CA14HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170066754-A1 ANTIVIRAL AGENT SHIONOGI & CO., LTD. (JP) 2017-03-09 US disclosed
US-9572813-B2 Antiviral agent SHIONOGI & CO., LTD. (JP) 2017-02-21 US disclosed
US-20150202208-A1 ANTIVIRAL AGENT SHIONOGI & CO., LTD. (JP) 2015-07-23 US disclosed
EP-1422218-B1 ANTIVIRAL AGENT SHIONOGI & CO (JP) 2012-03-21 EP 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 (2 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-20150202208-A1 ANTIVIRAL AGENT ZC3HAV1, ZC3HAV1L, CCNI CA14 4336/4885REN 564/4885TSHR 3427/4885
US-20170066754-A1 ANTIVIRAL AGENT ZC3HAV1, ZC3HAV1L, CCNI CA14 4336/4885REN 564/4885TSHR 3427/4885

“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.