SCHEMBL13570375

SCHEMBL13570375

NC(=O)C1(NC(=O)Cc2ccccc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.50
MAPT P10636 2/20 0.50
KDM4E B2RXH2 1/20 0.50
APAF1 O14727 1/20 0.50
TDP2 O95551 1/20 0.50
NSD2 O96028 1/20 0.50
KDM4C Q9H3R0 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
ALDH1A1 P00352 3/20 0.49
ADRB2 P07550 1/20 0.49
EPHX2 P34913 2/20 0.47
CNR2 P34972 3/20 0.45
HPGD P15428 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CYP2D6 P10635 1/20 0.45
MAPK8 P45983 2/20 0.43
GAA P10253 1/20 0.42

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
SCHEMBL24622807 0.82 ALDH1A1 (0.44) HTTMAPTKDM4EAPAF1TDP2
SCHEMBL1839710 0.79 ALDH1A1 (0.58) HTTMAPTKDM4EAPAF1TDP2
SCHEMBL23488008 0.77 CTSL (0.47) CNR2
SCHEMBL6206153 0.76 SMN1; SMN2 (0.47) HTTMAPTKDM4EAPAF1TDP2
SCHEMBL2394738 0.76 CTSS (0.55) HTTMAPTALDH1A1SMN1; SMN2GAA
SCHEMBL17033023 0.76 MEN1 (0.53) HTTMAPTKDM4EAPAF1TDP2
SCHEMBL24623054 0.75 CFD (0.47) KDM4EMEN1KMT2AEPHX2
Hydrochloric Acid SCHEMBL29158022 0.75 CTSS (0.54) HTTMAPTALDH1A1SMN1; SMN2GAA
SCHEMBL7331143 0.75 CTSB (0.43) HTTALDH1A1ADRB2EPHX2CYP2D6
SCHEMBL24622812 0.74 ALDH1A1 (0.42) HTTMAPTKDM4EAPAF1TDP2

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
CN-102791693-A Hepatitis c virus inhibitors BRISTOL MYERS SQUIBB CO 2012-11-21 CN claimed
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
EP-2519506-A1 HEPATITIS C VIRUS INHIBITORS Bristol-Myers Squibb Company (US) 2012-11-07 EP 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 HTT 2767/4885MAPT 2725/4885KDM4E 3330/4885
US-20130085147-A1 Hepatitis C Virus Inhibitors HAVCR2, MAVS, GTF3C1 HTT 2767/4885MAPT 2725/4885KDM4E 3330/4885

“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.