SCHEMBL4876748

SCHEMBL4876748

CN(C)C(=O)CSC(=N)N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 3/20 0.54
NOS1 P29475 5/20 0.42
CYP1A2 P05177 4/20 0.42
NOS3 P29474 4/20 0.42
NOS2 P35228 4/20 0.42
TSHR P16473 2/20 0.42
CYP2D6 P10635 1/20 0.42
HRH4 Q9H3N8 4/20 0.42
TDP1 Q9NUW8 4/20 0.42
ALDH1A1 P00352 2/20 0.42
HRH2 P25021 1/20 0.42
BLM P54132 1/20 0.41
HSD17B10 Q99714 1/20 0.41
BACE1 P56817 1/20 0.37
MAPT P10636 2/20 0.36
LMNA P02545 2/20 0.35
GAA P10253 1/20 0.35
CYP3A4 P08684 1/20 0.34
APEX1 P27695 1/20 0.34
SMN1; SMN2 Q16637 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
Hydrochloric Acid SCHEMBL8997511 0.98 CYP2C19 (0.52) CYP2C19NOS1CYP1A2NOS3NOS2
SCHEMBL21589371 0.73
SCHEMBL9697831 0.73 GAA (0.38) CYP2C19CYP1A2TSHRALDH1A1BLM
SCHEMBL13283101 0.73 KMT2A (0.65) CYP2C19NOS1NOS3NOS2TSHR
SCHEMBL1580624 0.72
SCHEMBL4279640 0.70
SCHEMBL23690531 0.70 LMNA (0.49) CYP2D6TDP1ALDH1A1HSD17B10MAPT
Hydrochloric Acid SCHEMBL9698273 0.70 HTT (0.42) CYP2D6TDP1ALDH1A1HSD17B10MAPT
SCHEMBL10703997 0.69 GAA (0.42) CYP2C19TSHRCYP2D6ALDH1A1HSD17B10
SCHEMBL10800984 0.69 HTT (0.48) TSHRCYP2D6ALDH1A1HSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080076771-A1 Thrombopoietin Receptor Agonists REITER LAWRENCE A 2008-03-27 US disclosed
EP-1794156-A2 TROMBOPOIETIN RECEPTOR AGONISTS Pfizer Products Incorporated (US) 2007-06-13 EP disclosed
WO-2006033005-A2 THROMBOPOIETIN RECEPTOR AGONISTS PFIZER PRODUCTS INC. (US) 2006-03-30 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 (1 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-20080076771-A1 Thrombopoietin Receptor Agonists MPL, THPO, TBXA2R CYP2C19 2736/4885NOS1 3194/4885CYP1A2 1892/4885

“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.