SCHEMBL3154872

SCHEMBL3154872

CN(C)Cc1ccc(-c2ccc(NC(=O)Nc3cccnc3Oc3ccccc3C(C)(C)C)c(F)c2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
P2RY1 P47900 20/20 1.00
KCNH2 Q12809 2/20 0.79
P2RY14 Q15391 1/20 0.55

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
SCHEMBL30043354 1.00 P2RY1 (1.00) P2RY1KCNH2P2RY14
SCHEMBL30042785 0.93 P2RY1 (1.00) P2RY1KCNH2P2RY14
SCHEMBL3151337 0.93 P2RY1 (1.00) P2RY1KCNH2P2RY14
SCHEMBL30042972 0.93 P2RY1 (1.00) P2RY1KCNH2P2RY14
SCHEMBL3146567 0.93 P2RY1 (1.00) P2RY1KCNH2P2RY14
SCHEMBL3154893 0.84 P2RY1 (1.00) P2RY1KCNH2P2RY14
SCHEMBL3150304 0.82 P2RY1 (1.00) P2RY1KCNH2P2RY14
SCHEMBL3159850 0.82 P2RY1 (0.85) P2RY1KCNH2P2RY14
SCHEMBL3155301 0.81 P2RY1 (0.84) P2RY1KCNH2P2RY14
SCHEMBL3163537 0.81 P2RY1 (1.00) P2RY1KCNH2P2RY14

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
EP-1751113-B1 UREA ANTAGONISTS OF P2Y1 RECEPTOR USEFUL IN THE TREATMENT OF THROMBOTIC CONDITIONS BRISTOL MYERS SQUIBB CO (US) 2010-03-10 EP claimed
US-7388021-B2 Urea antagonists of P2Y1 receptor useful in the treatment of thrombotic conditions BRISTOL MYERS SQUIBB COMPANY (US) 2008-06-17 US claimed
US-20050267119-A1 Urea antagonists of P2Y1 receptor useful in the treatment of thrombotic conditions BRISTOL-MYERS SQUIBB COMPANY 2005-12-01 US claimed

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-20050267119-A1 Urea antagonists of P2Y1 receptor useful in the treatment of thrombotic conditions P2RY1, P2RY11, P2RY2 P2RY1 1/4885KCNH2 2493/4885P2RY14 14/4885

“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.