SCHEMBL3563341

SCHEMBL3563341

CCOC(=O)CO[C@@H](c1cccc(F)c1-c1cccc(C)c1)[C@H]1CN(C(=O)OC(C)(C)C)CCO1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.38
GPR119 Q8TDV5 6/20 0.36
KAT6A Q92794 2/20 0.36
KAT5 Q92993 2/20 0.36
KAT7 O95251 1/20 0.36
MAPT P10636 2/20 0.35
BTK Q06187 1/20 0.35
USP30 Q70CQ3 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HDAC6 Q9UBN7 1/20 0.32
DPP4 P27487 1/20 0.32
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL3563340 1.00 REN (0.38) RENGPR119KAT6AKAT5KAT7
SCHEMBL2850917 1.00 REN (0.38) RENGPR119KAT6AKAT5KAT7
SCHEMBL2844376 0.92 REN (0.39) RENGPR119KAT6AKAT5KAT7
SCHEMBL2852276 0.90 REN (0.40) RENMAPTSMN1; SMN2DPP4TP53
SCHEMBL2852273 0.90 REN (0.40) RENMAPTSMN1; SMN2DPP4TP53
SCHEMBL3882190 0.90 GPR119 (0.40) RENGPR119KAT6AKAT5KAT7
SCHEMBL3568207 0.89 REN (0.42) RENGPR119KAT6AKAT5KAT7
SCHEMBL3568210 0.89 REN (0.42) RENGPR119KAT6AKAT5KAT7
SCHEMBL3557758 0.89 REN (0.43) RENGPR119KAT6AKAT5KAT7
SCHEMBL3557756 0.89 REN (0.43) RENGPR119KAT6AKAT5KAT7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007117482-A2 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. (US) 2007-10-18 WO claimed
US-7858624-B2 Piperidine and morpholine renin inhibitors VITAE PHARMACEUTICALS, INC. (US) 2010-12-28 US disclosed
US-7858624-B2 Piperidine and morpholine renin inhibitors VITAE PHARMACEUTICALS, INC. (US) 2010-12-28 US disclosed
US-20100130471-A1 Renin Inhibitors SMITHKLINE BEECHAM CORPORATION 2010-05-27 US disclosed
US-20090275581-A1 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. 2009-11-05 US disclosed
US-20090275581-A1 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. 2009-11-05 US disclosed
US-20090264428-A1 Renin Inhibitors VITAE PHARMACEUTICALS, INC. 2009-10-22 US disclosed
US-20090264428-A1 Renin Inhibitors VITAE PHARMACEUTICALS, INC. 2009-10-22 US disclosed
US-20090264432-A1 Piperidine and Morpholine Renin Inhibitors VITAE PHARMACEUTICALS, INC. 2009-10-22 US disclosed
US-20090264432-A1 Piperidine and Morpholine Renin Inhibitors VITAE PHARMACEUTICALS, INC. 2009-10-22 US disclosed
EP-2010488-A2 RENIN INHIBITORS Vitae Pharmaceuticals, Inc. (US) 2009-01-07 EP disclosed
WO-2008124582-A1 RENIN INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-10-16 WO disclosed
WO-2007117560-A2 PIPERIDINE AND MORPHOLINE RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. (US) 2007-10-18 WO disclosed
WO-2007117559-A2 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. (US) 2007-10-18 WO disclosed
WO-2007117482-A2 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. (US) 2007-10-18 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 (4 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-20090275581-A1 RENIN INHIBITORS REN, ACE, SERPINB1 REN 1/4885GPR119 720/4885KAT6A 4428/4885
US-20090264432-A1 Piperidine and Morpholine Renin Inhibitors REN, ACE, PREP REN 1/4885GPR119 1165/4885KAT6A 2746/4885
US-20090264428-A1 Renin Inhibitors REN, ACE, SERPINB1 REN 1/4885GPR119 478/4885KAT6A 4029/4885
US-20100130471-A1 Renin Inhibitors ACE, REN, DNPEP REN 2/4885GPR119 1070/4885KAT6A 3919/4885

“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.