SCHEMBL4722802

SCHEMBL4722802

CCCN(C)c1csnn1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 1/20 0.37
MAPK11 Q15759 1/20 0.37
MAPK14 Q16539 1/20 0.37
HCAR3 P49019 1/20 0.37
KMT2A Q03164 1/20 0.31
DRD2 P14416 1/20 0.31
DRD3 P35462 1/20 0.31
DAO P14920 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
SCHEMBL4721411 0.89 AR (0.38) CSNK1DMAPK11MAPK14KMT2A
SCHEMBL4765478 0.82 HCAR3 (0.39) HCAR3KMT2ADRD2DRD3
SCHEMBL4723075 0.78 HCAR3 (0.33) HCAR3KMT2ADRD2DRD3
SCHEMBL4722793 0.76 HCAR3 (0.35) HCAR3DRD2DRD3
SCHEMBL4765239 0.74 LMNA (0.33) HCAR3KMT2A
SCHEMBL4720098 0.72 CRHR1 (0.33) KMT2A
SCHEMBL28136356 0.70
SCHEMBL4723677 0.68 HCAR3 (0.37) CSNK1DMAPK11MAPK14HCAR3DAO
SCHEMBL4723828 0.68 HCAR3 (0.37) CSNK1DMAPK11MAPK14HCAR3DAO
SCHEMBL4721493 0.64 HCAR3 (0.37) CSNK1DMAPK11MAPK14HCAR3DAO

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-20080176857-A1 4-Piperazinnylthieno[2,3-d]Pyrimidine Compounds as Platelet Aggregation Inhibitors PFIZER INC. 2008-07-24 US disclosed
EP-1874780-A1 4-PIPERAZINYLTHIENO[2,3-D]PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS Pharmacia & Upjohn Company LLC (US) 2008-01-09 EP disclosed
WO-2006100591-A1 4-PIPERAZINNYLTHIENO [2,3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-09-28 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-20080176857-A1 4-Piperazinnylthieno[2,3-d]Pyrimidine Compounds as Platelet Aggregation Inhibitors TBXA2R, P2RY4, PF4 CSNK1D 2000/4885MAPK11 4406/4885MAPK14 4347/4885

“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.