SCHEMBL2884362

SCHEMBL2884362

CCn1c(-c2ccc(NS(=O)(=O)CC)cc2)c(C#N)c2ccc(CO)cc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 3/20 0.45
PGR P06401 9/20 0.42
NR3C1 P04150 4/20 0.39
NR3C2 P08235 4/20 0.39
AR P10275 3/20 0.39
HPGD P15428 4/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP19A1 P11511 1/20 0.38
CYP11B1 P15538 1/20 0.38
RORC P51449 1/20 0.36
ALDH1A1 P00352 1/20 0.35
THRB P10828 1/20 0.35
IMPDH2 P12268 1/20 0.35
KIF11 P52732 1/20 0.34
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PLK4 O00444 1/20 0.34
DAPK3 O43293 1/20 0.34

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
SCHEMBL12996795 0.90 CYP11B2 (0.47) CYP11B2PGRNR3C1NR3C2AR
SCHEMBL10095410 0.88 CYP11B2 (0.46) CYP11B2PGRNR3C1NR3C2AR
SCHEMBL12107168 0.87 CYP11B2 (0.48) CYP11B2PGRNR3C1NR3C2AR
SCHEMBL10096619 0.87 CYP11B2 (0.43) CYP11B2PGRNR3C1NR3C2AR
SCHEMBL10096614 0.85 CYP11B2 (0.42) CYP11B2PGRNR3C1NR3C2AR
SCHEMBL10096613 0.85 CYP11B2 (0.44) CYP11B2PGRNR3C1NR3C2AR
SCHEMBL10095333 0.84 GRIK2 (0.46) CYP11B2PGRNR3C1NR3C2AR
SCHEMBL10096618 0.83 CYP11B2 (0.40) CYP11B2PGRNR3C1NR3C2AR
SCHEMBL2884492 0.83 HPGD (0.51) CYP11B2PGRNR3C1NR3C2AR
SCHEMBL10095546 0.83 KIF11 (0.52) CYP11B2PGRNR3C1NR3C2AR

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 10 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-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-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
US-20070299068-A1 Methods for treating hepatitis C PTC THERAPEUTICS, INC. 2007-12-27 US disclosed
WO-2007084413-A2 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2007-07-26 WO 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 CYP11B2 1863/4885PGR 1823/4885NR3C1 957/4885
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS CYP11B2 1863/4885PGR 1823/4885NR3C1 957/4885

“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.