SCHEMBL56847

SCHEMBL56847

COC(=O)[C@@H](CC(C)C)N(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPOR P19235 2/20 0.52
MMP1 P03956 4/20 0.51
MMP3 P08254 3/20 0.51
MMP2 P08253 2/20 0.49
MMP9 P14780 2/20 0.49
MMP8 P22894 2/20 0.49
MMP7 P09237 1/20 0.49
CA2 P00918 2/20 0.48
CA12 O43570 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ATM Q13315 1/20 0.46
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
BIRC2 Q13490 1/20 0.43
ANPEP P15144 1/20 0.43
CA1 P00915 1/20 0.43

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
SCHEMBL55668 1.00 EPOR (0.52) EPORMMP1MMP3MMP2MMP9
SCHEMBL55669 1.00 EPOR (0.52) EPORMMP1MMP3MMP2MMP9
SCHEMBL28784089 0.87 MMP1 (0.50) MMP1MMP3MMP2MMP9MMP8
SCHEMBL5021049 0.87 CTSB (0.49) EPORMMP1MMP3MMP2MMP9
SCHEMBL28784090 0.87 MMP1 (0.50) MMP1MMP3MMP2MMP9MMP8
SCHEMBL3854880 0.84 EPOR (0.54) EPORMEN1KMT2AATMMAPT
SCHEMBL1697393 0.84 EPOR (0.54) EPORCA2CA12CA7CA9
SCHEMBL83747 0.84 EPOR (0.54) EPORCA2CA12CA7CA9
SCHEMBL3854879 0.84 EPOR (0.54) EPORMEN1KMT2AATMMAPT
SCHEMBL3363612 0.84 EPOR (0.54) EPORCA2CA12CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129411-B2 Organic compounds NOVARTIS AG (CH) 2012-03-06 US disclosed
EP-2420491-A1 3 , 5-substitued piperidine compounds as renin inhibitors Novartis AG (CH) 2012-02-22 EP disclosed
US-20090192148-A1 Organic Compounds NOVARTIS AG (CH) 2009-07-30 US disclosed
EP-1968940-A1 3 , 5-SUBSTITUED PIPERIDINE COMPOUNDS AS RENIN INHIBITORS Novartis AG (CH) 2008-09-17 EP disclosed
WO-2007077005-A1 3 , 5-SUBSTITΓUED PIPERIDINE COMPOUNDS AS RENIN INHIBITORS NOVARTIS AG (CH) 2007-07-12 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-20090192148-A1 Organic Compounds REN, ACE, AGTR1 EPOR 34/4885MMP1 47/4885MMP3 202/4885

“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.