SCHEMBL10096335

SCHEMBL10096335

CCn1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)c(C#N)c2ccc(OC3CC3)cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SGK1 O00141 2/20 0.37
MAP2K4 P45985 2/20 0.36
PRKAA2 P54646 1/20 0.36
CYP11B2 P19099 2/20 0.35
RORC P51449 2/20 0.35
ALDH2 P05091 1/20 0.35
PGR P06401 2/20 0.34
ACSL1 P33121 1/20 0.34
UCHL1 P09936 1/20 0.34
USP30 Q70CQ3 1/20 0.34
PRMT6 Q96LA8 2/20 0.33
NR3C1 P04150 1/20 0.33
NR3C2 P08235 1/20 0.33
AR P10275 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
PRMT1 Q99873 1/20 0.33
PRMT8 Q9NR22 1/20 0.33
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
BRPF1 P55201 1/20 0.33

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
SCHEMBL10095465 0.91 GRIK2 (0.42) SGK1MAP2K4CYP11B2ALDH2PGR
SCHEMBL10095983 0.88 PGR (0.39) CYP11B2ALDH2PGRNR3C1NR3C2
SCHEMBL10096184 0.88 IDH1 (0.39) SGK1MAP2K4CYP11B2ALDH2PGR
SCHEMBL10096230 0.88 MAP2K4 (0.35) SGK1MAP2K4CYP11B2ALDH2PGR
SCHEMBL10095725 0.87 PRMT6 (0.35) SGK1MAP2K4CYP11B2ALDH2UCHL1
SCHEMBL13152372 0.86 SGK1 (0.43) SGK1MAP2K4RORCALDH2PRMT6
SCHEMBL12995347 0.85 NSD2 (0.35) SGK1MAP2K4PRKAA2ALDH2UCHL1
SCHEMBL12105771 0.85 AS3MT (0.40) UCHL1USP30PRMT6PRMT1PRMT8
SCHEMBL10095986 0.84 DYRK1A (0.38) SGK1MAP2K4CYP11B2ALDH2UCHL1
SCHEMBL10095940 0.84 GRIK2 (0.49) ALDH2UCHL1USP30IDO1TDO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8927576-B2 HCV inhibitor and therapeutic agent combinations PTC Therpeutics, Inc. (US) 2015-01-06 US disclosed
US-8927576-B2 HCV inhibitor and therapeutic agent combinations PTC Therpeutics, Inc. (US) 2015-01-06 US disclosed
US-20120027721-A1 HCV Inhibitor and Therapeutic Agent Combinations PTC THERAPEUTICS, INC. (US) 2012-02-02 US disclosed
US-20120027721-A1 HCV Inhibitor and Therapeutic Agent Combinations PTC THERAPEUTICS, INC. (US) 2012-02-02 US disclosed
US-20110268698-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2011-11-03 US disclosed
US-20110268698-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2011-11-03 US disclosed
US-7973069-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-07-05 US disclosed
US-7868037-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-01-11 US disclosed
US-7868037-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-01-11 US disclosed
US-20100292187-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-11-18 US disclosed
US-7781478-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2010-08-24 US disclosed
US-7781478-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2010-08-24 US disclosed
US-20070299069-A1 Methods for treating hepatitis C PTC THERAPEUTICS, INC. 2007-12-27 US disclosed
US-20070299069-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 (4 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-20110268698-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, LIPC, HCCS SGK1 3784/4885MAP2K4 4863/4885PRKAA2 2751/4885
US-20100292187-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS SGK1 2038/4885MAP2K4 4847/4885PRKAA2 2027/4885
US-20070299069-A1 Methods for treating hepatitis C HAVCR2, EIF2AK2, MAVS SGK1 2038/4885MAP2K4 4847/4885PRKAA2 2027/4885
US-20120027721-A1 HCV Inhibitor and Therapeutic Agent Combinations HAVCR2, SERPINB1, ENPEP SGK1 3570/4885MAP2K4 3400/4885PRKAA2 3046/4885

“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.