SCHEMBL14940665

SCHEMBL14940665

NC(=NC(=O)O)n1cccn1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 9/20 0.51
FBP1 P09467 1/20 0.38
ELANE P08246 1/20 0.38

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
SCHEMBL15366422 1.00 NOS1 (0.51) NOS1FBP1ELANE
SCHEMBL8820639 0.86 NOS1 (0.53) NOS1FBP1ELANE
SCHEMBL14936428 0.79 NOS1 (0.49) NOS1ELANE
SCHEMBL11686773 0.78 NOS1 (0.61) NOS1FBP1
Hydrochloric Acid SCHEMBL2378442 0.77 NOS1 (0.59) NOS1FBP1
SCHEMBL7499635 0.77 NOS1 (0.58) NOS1
Carbamic Acid SCHEMBL612588 0.76 NOS1 (0.41) NOS1ELANE
SCHEMBL5391387 0.75
SCHEMBL19545548 0.75
SCHEMBL1421922 0.75 NOS1 (0.45) NOS1ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9873673-B2 2-thiopyrimidinones PFIZER INC. (US) 2018-01-23 US disclosed
US-20160304469-A1 2-Thiopyrimidinones PFIZER INC. (US) 2016-10-20 US disclosed
US-9399626-B2 2-thiopyrimidinones PFIZER INC. (US) 2016-07-26 US disclosed
US-20140288049-A1 2-Thiopyrimidinones PFIZER (US) 2014-09-25 US disclosed
US-8841314-B2 2-Thiopyrimidinones PFIZER INC. (US) 2014-09-23 US disclosed
EP-2776405-A1 2-THIOPYRIMIDINONES Pfizer Inc (US) 2014-09-17 EP disclosed
US-20130296351-A1 2-Thiopyrimidinones PFIZER INC. 2013-11-07 US disclosed
WO-2013068875-A1 2-THIOPYRIMIDINONES PFIZER INC. (US) 2013-05-16 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 (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-20160304469-A1 2-Thiopyrimidinones MPO, SERPINB1, TNNI3 NOS1 397/4885FBP1 1006/4885ELANE 67/4885
US-20140288049-A1 2-Thiopyrimidinones MPO, SERPINB1, TNNI3 NOS1 397/4885FBP1 1006/4885ELANE 67/4885
US-20130296351-A1 2-Thiopyrimidinones MPO, SERPINB1, TNNI3 NOS1 397/4885FBP1 1006/4885ELANE 67/4885

“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.