SCHEMBL7869597

SCHEMBL7869597

CC(C)CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C(=O)O)[C@H]1O)c1cc(OCCCOCc2ccccc2)c(C(C)C)cn1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 4/20 0.45
▸ PDE4B Q07343 1/20 0.38
▸ USP30 Q70CQ3 4/20 0.35
▸ TACR1 P25103 3/20 0.35
▸ FGFR1 P11362 3/20 0.34
▸ KDR P35968 3/20 0.34
▸ GPR119 Q8TDV5 2/20 0.34
▸ YAP1 P46937 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL16692349 1.00 REN (0.45) RENPDE4BUSP30TACR1FGFR1
SCHEMBL7858492 0.94 REN (0.45) RENPDE4BUSP30TACR1FGFR1
SCHEMBL7866496 0.88 REN (0.62) REN
SCHEMBL13985762 0.88 REN (0.49) RENPDE4BUSP30GPR119
SCHEMBL7869566 0.80 REN (0.53) RENPDE4BGPR119
SCHEMBL7858374 0.77 REN (0.54) RENPDE4BUSP30
SCHEMBL7866727 0.76 REN (0.76) REN
SCHEMBL14479781 0.75 REN (0.80) REN
SCHEMBL7866711 0.74 REN (0.50) RENPDE4BGPR119
SCHEMBL7866669 0.74 REN (0.55) RENPDE4BUSP30

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8497286-B2 Organic compounds NOVARTIS AG (CH) 2013-07-30 — — US disclosed
US-8497286-B2 Organic compounds NOVARTIS AG (CH) 2013-07-30 — — US disclosed
US-8383650-B2 Organic compounds NOVARTIS AG (CH) 2013-02-26 — — US disclosed
US-8383650-B2 Organic compounds NOVARTIS AG (CH) 2013-02-26 — — US disclosed
US-20130005770-A1 ORGANIC COMPOUNDS NOVARTIS AG 2013-01-03 — — US disclosed
US-20130005770-A1 ORGANIC COMPOUNDS NOVARTIS AG 2013-01-03 — — US disclosed
WO-2009000811-A1 N5-(2-ETHOXYETHYL)-N3-(2-PYRIDINYL)-3,5-PIPERIDINEDICARBOXAMIDE DERIVATIVES FOR USE AS RENIN INHIBITORS NOVARTIS AG (CH) 2008-12-31 — — WO disclosed
US-20080319018-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-12-25 — — US disclosed
US-20080319018-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-12-25 — — US 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 (2 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-20080319018-A1 ORGANIC COMPOUNDS REN, ACE, AGTR1 REN 1/4885PDE4B 2237/4885USP30 3551/4885
US-20130005770-A1 ORGANIC COMPOUNDS REN, ACE, AGTR1 REN 1/4885PDE4B 2237/4885USP30 3551/4885

“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.

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