SCHEMBL16670794

SCHEMBL16670794

CN(C(=O)C(Cc1cc(F)cc(F)c1)NC(=O)NS(=O)(=O)c1cc(F)ccc1F)c1ccc2scnc2c1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
NR3C2 P08235 2/20 0.32
MAPT P10636 1/20 0.31
PYGL P06737 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PDE10A Q9Y233 1/20 0.31
MMP2 P08253 2/20 0.30
MMP8 P22894 2/20 0.30
MMP1 P03956 1/20 0.30
MMP9 P14780 1/20 0.30
TRPV3 Q8NET8 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL16670792 1.00 SMN1; SMN2 (0.33) SMN1; SMN2ALOX5APFEN1NR3C2MAPT
SCHEMBL16669969 0.94 KCNH2 (0.33) SMN1; SMN2ALOX5APFEN1NR3C2MAPT
SCHEMBL16669968 0.94 KCNH2 (0.33) SMN1; SMN2ALOX5APFEN1NR3C2MAPT
SCHEMBL20427722 0.92 ALOX5AP (0.32) SMN1; SMN2ALOX5APFEN1MAPTNPC1
SCHEMBL16670643 0.92 ALOX5AP (0.38) SMN1; SMN2ALOX5APFEN1MAPTPYGL
SCHEMBL16670640 0.92 ALOX5AP (0.38) SMN1; SMN2ALOX5APFEN1MAPTPYGL
SCHEMBL18181173 0.89 PDE10A (0.31) PDE10A
SCHEMBL20782939 0.89 PDE10A (0.31) PDE10A
SCHEMBL18041063 0.89 MMP2 (0.39) SMN1; SMN2ALOX5APFEN1MAPTPYGL
SCHEMBL16682001 0.89 MMP2 (0.39) SMN1; SMN2ALOX5APFEN1MAPTPYGL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10035760-B2 Inhibitors of human immunodeficiency virus replication VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2018-07-31 US disclosed
US-10035760-B2 Inhibitors of human immunodeficiency virus replication VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2018-07-31 US disclosed
US-20160257645-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV Healthcare UK (No.5) Limited (GB) 2016-09-08 US disclosed
EP-3060554-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION Bristol-Myers Squibb Company (US) 2016-08-31 EP disclosed
WO-2015061518-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BRISTOL-MYERS SQUIBB COMPANY (US) 2015-04-30 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-20160257645-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION EIF2AK2, POLR1E, POLR1G SMN1; SMN2 2838/4885ALOX5AP 3760/4885FEN1 274/4885
US-10035760-B2 Inhibitors of human immunodeficiency virus replication EIF2AK2, POLR1G, POLR1E SMN1; SMN2 2877/4885ALOX5AP 3365/4885FEN1 226/4885

“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.