SCHEMBL3372607

SCHEMBL3372607

COCCC1CC1(N)C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 5/20 0.36
GRM8 O00222 3/20 0.36
GRM6 O15303 2/20 0.36
GRM2 Q14416 2/20 0.35
GRM5 P41594 1/20 0.35
GRM1 Q13255 1/20 0.35
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TSHR P16473 1/20 0.34
EPHX2 P34913 1/20 0.33
ATM Q13315 1/20 0.33
NPSR1 Q6W5P4 1/20 0.31
ARG1 P05089 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
SCHEMBL13757807 1.00 GRM4 (0.36) GRM4GRM8GRM6GRM2GRM5
Hydrochloric Acid SCHEMBL28747483 0.89 EPHX2 (0.36) GRM4GRM8GRM6GRM2GRM5
SCHEMBL3369422 0.84 GRM2 (0.36) GRM4GRM8GRM6GRM2GRM5
SCHEMBL3370713 0.84 GRM2 (0.36) GRM4GRM8GRM6GRM2GRM5
SCHEMBL13757783 0.84 GRM2 (0.36) GRM4GRM8GRM6GRM2GRM5
SCHEMBL13757812 0.84 GRM2 (0.36) GRM4GRM8GRM6GRM2GRM5
Hydrochloric Acid SCHEMBL28747513 0.83 EPHX2 (0.35) GRM2GRM5GRM1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL3375949 0.82 GRM2 (0.35) GRM4GRM8GRM6GRM2GRM5
SCHEMBL2738357 0.82 GRM2 (0.35) GRM4GRM8GRM6GRM2GRM5
SCHEMBL28747535 0.81 ARG1 (0.35) GRM4GRM8GRM6GRM2GRM5

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-8809267-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2014-08-19 US disclosed
US-20140051626-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2014-02-20 US disclosed
US-8513186-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2013-08-20 US disclosed
EP-2162432-A2 ANTIVIRAL COMPOUNDS Gilead Sciences, Inc. (US) 2010-03-17 EP disclosed
US-20090186869-A1 Antiviral compounds GILEAD SCIENCES, INC. (US) 2009-07-23 US disclosed
WO-2009005677-A2 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2009-01-08 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-20090186869-A1 Antiviral compounds MAVS, EIF2AK2, ZC3HAV1 GRM4 3870/4885GRM8 4026/4885GRM6 3534/4885
US-20140051626-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 GRM4 3870/4885GRM8 4026/4885GRM6 3534/4885

“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.