SCHEMBL10366103

SCHEMBL10366103

CN1CCC(c2cc(-c3ccc(NC(=O)c4cscn4)cc3)sc2C(=O)O)=C([C@H]2CC[C@H](C)CC2)C1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.35
GRM4 Q14833 3/20 0.35
ROCK2 O75116 3/20 0.33
GRM1 Q13255 1/20 0.33
MAPK14 Q16539 1/20 0.33
ADORA2A P29274 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
F10 P00742 3/20 0.31
F2 P00734 1/20 0.31
F9 P00740 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
F7 P08709 1/20 0.31
PRSS3 P35030 1/20 0.31
CSNK1D P48730 1/20 0.30
CSNK1E P49674 1/20 0.30
PIM1 P11309 1/20 0.30
CRACR2A Q9BSW2 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
SCHEMBL10324459 1.00 NAMPT (0.35) NAMPTGRM4ROCK2GRM1MAPK14
SCHEMBL10324659 0.95 GRM4 (0.35) NAMPTGRM4ROCK2GRM1MAPK14
SCHEMBL10325384 0.93 NAMPT (0.35) NAMPTGRM4ROCK2GRM1MAPK14
SCHEMBL15638571 0.93 NAMPT (0.36) NAMPTGRM4ROCK2GRM1MAPK14
SCHEMBL10325287 0.91 NAMPT (0.34) NAMPTGRM4ROCK2GRM1PTGDR2
SCHEMBL15639622 0.91 CDK9 (0.34) NAMPTF10F2F9PRSS1
SCHEMBL10324542 0.90 NAMPT (0.35) NAMPTGRM4ROCK2GRM1F10
SCHEMBL10324670 0.90 GRM4 (0.43) NAMPTGRM4
SCHEMBL9975776 0.90 GRM4 (0.43) NAMPTGRM4
SCHEMBL10325054 0.90 KMT2A (0.35) NAMPTGRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10426762-B2 Inhibitors of hepatitis C virus polymerase COCRYSTAL PHARMA, INC. (US) 2019-10-01 US disclosed
US-9707215-B2 Inhibitors of hepatitis C virus polymerase COCRYSTAL, DISCOVERY, INC. (US) 2017-07-18 US disclosed
US-9707215-B2 Inhibitors of hepatitis C virus polymerase COCRYSTAL, DISCOVERY, INC. (US) 2017-07-18 US disclosed
US-20150182514-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL PHARMA, INC. 2015-07-02 US disclosed
US-20150182514-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL PHARMA, INC. 2015-07-02 US disclosed
US-8771665-B2 Inhibitors of hepatitis C virus polymerase COCRYSTAL DISCOVERY, INC. (US) 2014-07-08 US disclosed
US-8771665-B2 Inhibitors of hepatitis C virus polymerase COCRYSTAL DISCOVERY, INC. (US) 2014-07-08 US disclosed
US-20120183496-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL DISCOVERY, INC. (US) 2012-07-19 US disclosed
US-20120183496-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL DISCOVERY, INC. (US) 2012-07-19 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 (3 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-10426762-B2 Inhibitors of hepatitis C virus polymerase POLR2E, POLR2H, GTF3C3 NAMPT 2745/4885GRM4 4636/4885ROCK2 2364/4885
US-20120183496-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE POLR2A, POLR2B, POLR2E NAMPT 3698/4885GRM4 4609/4885ROCK2 1795/4885
US-20150182514-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE POLR2E, POLR2H, GTF3C3 NAMPT 2745/4885GRM4 4636/4885ROCK2 2364/4885

“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.