SCHEMBL14647889

SCHEMBL14647889

CCC(=O)NNC(=O)Cc1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.65
KMT2A Q03164 4/20 0.65
ALDH1A1 P00352 4/20 0.65
KDM4E B2RXH2 1/20 0.62
LMNA P02545 1/20 0.62
GAA P10253 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
HDAC8 Q9BY41 1/20 0.59
HDAC6 Q9UBN7 1/20 0.59
CYP2C19 P33261 1/20 0.55
PDCD1 Q15116 1/20 0.55
CD274 Q9NZQ7 1/20 0.55
PLAU P00749 1/20 0.55
ELANE P08246 1/20 0.55
EPHX2 P34913 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.54
POLB P06746 1/20 0.53

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
SCHEMBL7107935 0.89 ALDH1A1 (0.77) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL14648001 0.85 MEN1 (0.76) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL9061005 0.84 ALDH1A1 (0.65) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL14192474 0.84 MEN1 (0.59) MEN1KMT2AALDH1A1LMNAGAA
SCHEMBL9563921 0.83 ALDH1A1 (0.75) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL11030835 0.82 MEN1 (0.58) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL5089606 0.82 ALDH1A1 (0.61) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL29148895 0.81 MEN1 (0.72) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL10566602 0.81 ALDH1A1 (0.68) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL28868420 0.81 HTT (0.53) MEN1KMT2AALDH1A1KDM4ELMNA

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-8735398-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-05-27 US disclosed
US-20130085147-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-04-04 US disclosed
US-8362020-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-29 US disclosed
US-20110294819-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2011-12-01 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 (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-20110294819-A1 Hepatitis C Virus Inhibitors HAVCR2, MAVS, GTF3C1 MEN1 4812/4885KMT2A 3866/4885ALDH1A1 3778/4885
US-20130085147-A1 Hepatitis C Virus Inhibitors HAVCR2, MAVS, GTF3C1 MEN1 4812/4885KMT2A 3866/4885ALDH1A1 3778/4885

“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.