SCHEMBL4893710

SCHEMBL4893710

CCc1cc2c(N3CCN(C(=O)Cc4ccccc4)CC3)nc(Nc3ccccc3)nc2s1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 19/20 0.72
MEN1 O00255 2/20 0.51
ALDH1A1 P00352 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL5849285 0.91 P2RY12 (0.74) P2RY12MEN1
SCHEMBL4897082 0.90 P2RY12 (0.73) P2RY12MEN1ALDH1A1KMT2A
SCHEMBL4894632 0.88 P2RY12 (0.73) P2RY12MEN1ALDH1A1KMT2A
SCHEMBL4892597 0.87 P2RY12 (0.69) P2RY12MEN1
SCHEMBL5849255 0.87 P2RY12 (0.75) P2RY12MEN1ALDH1A1KMT2A
SCHEMBL4897011 0.86 P2RY12 (0.70) P2RY12MEN1ALDH1A1KMT2A
SCHEMBL4893756 0.86 P2RY12 (0.74) P2RY12MEN1ALDH1A1KMT2A
SCHEMBL4893708 0.86 P2RY12 (0.68) P2RY12MEN1
SCHEMBL5265542 0.86 P2RY12 (0.74) P2RY12MEN1ALDH1A1KMT2A
SCHEMBL5849412 0.86 P2RY12 (0.74) P2RY12MEN1ALDH1A1KMT2A

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-20080194590-A1 4-Piperazinylthieno [2,3-D] Pyrimidine Compounds as Platelet Aggregation Inhibitors PFIZER INC 2008-08-14 US disclosed
EP-1869051-A1 4-PIPERAZINYLTHIENO Ý2,3-D¨PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS Pharmacia & Upjohn Company LLC (US) 2007-12-26 EP disclosed
WO-2006103545-A1 4-PIPERAZINYLTHIENO [2,3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-10-05 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-20080194590-A1 4-Piperazinylthieno [2,3-D] Pyrimidine Compounds as Platelet Aggregation Inhibitors PFKP, PF4, P2RY4 P2RY12 20/4885MEN1 4545/4885ALDH1A1 1204/4885

“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.