SCHEMBL12995346

SCHEMBL12995346

N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(C2CC2)c2cc(OC3CCOC3)ccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SGK1 O00141 2/20 0.35
MAP2K4 P45985 2/20 0.34
SOS1 Q07889 1/20 0.33
CYP11B2 P19099 1/20 0.33
TBK1 Q9UHD2 3/20 0.32
JAK2 O60674 1/20 0.32
BRD4 O60885 2/20 0.32
UCHL1 P09936 1/20 0.32
USP30 Q70CQ3 1/20 0.32
ALDH2 P05091 1/20 0.32
HRH3 Q9Y5N1 2/20 0.31
MAPK8 P45983 1/20 0.31
MAPK9 P45984 1/20 0.31
F2 P00734 2/20 0.31
F10 P00742 2/20 0.31
PRSS1 P07477 2/20 0.31
PRSS2 P07478 2/20 0.31
F7 P08709 2/20 0.31
F3 P13726 2/20 0.31
PRSS3 P35030 2/20 0.31

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
SCHEMBL12995299 0.97 HRH3 (0.35) SGK1MAP2K4SOS1CYP11B2TBK1
SCHEMBL12995350 0.96 SGK1 (0.36) SGK1MAP2K4CYP11B2TBK1JAK2
SCHEMBL12995302 0.93 SGK1 (0.35) SGK1MAP2K4CYP11B2TBK1JAK2
SCHEMBL12995342 0.89 SGK1 (0.34) SGK1MAP2K4CYP11B2UCHL1USP30
SCHEMBL12995926 0.88 SGK1 (0.35) SGK1MAP2K4UCHL1USP30
SCHEMBL12995918 0.87 BRD4 (0.39) CYP11B2TBK1JAK2BRD4ALDH2
SCHEMBL14467869 0.87 SGK1 (0.40) SGK1MAP2K4SOS1BRD4HRH3
SCHEMBL12995925 0.87 SGK1 (0.36) SGK1MAP2K4BRD4UCHL1USP30
SCHEMBL12995915 0.86 BRD4 (0.40) CYP11B2TBK1JAK2BRD4F2
SCHEMBL12995504 0.86 HRH3 (0.35) SGK1MAP2K4CYP11B2TBK1JAK2

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
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-7772271-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2010-08-10 US disclosed
US-7772271-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2010-08-10 US disclosed
US-20070299068-A1 Methods for treating hepatitis C PTC THERAPEUTICS, INC. 2007-12-27 US disclosed
US-20070299068-A1 Methods for treating hepatitis C PTC THERAPEUTICS, INC. 2007-12-27 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-20070299068-A1 Methods for treating hepatitis C HAVCR2, EIF2AK2, MAVS SGK1 2038/4885MAP2K4 4847/4885SOS1 4297/4885
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS SGK1 2038/4885MAP2K4 4847/4885SOS1 4297/4885

“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.