SCHEMBL90304

SCHEMBL90304

CCOC[C@H](N)CC1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 2/20 0.35
▸ AKT1 P31749 2/20 0.34
▸ METAP2 P50579 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ REN P00797 2/20 0.31
▸ SLC1A3 P43003 1/20 0.31
▸ SLC1A2 P43004 1/20 0.31
▸ SLC1A1 P43005 1/20 0.31

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
SCHEMBL89518 1.00 DPP4 (0.35) DPP4AKT1METAP2CYP1A2REN
SCHEMBL16229648 0.85 REN (0.35) DPP4AKT1METAP2CYP1A2REN
SCHEMBL90350 0.80 DPP4 (0.36) DPP4AKT1METAP2SLC1A3SLC1A2
SCHEMBL8235325 0.80 DPP4 (0.36) DPP4AKT1METAP2SLC1A3SLC1A2
SCHEMBL90271 0.80 DPP4 (0.36) DPP4AKT1METAP2SLC1A3SLC1A2
SCHEMBL13889045 0.78 CYP1A2 (0.34) CYP1A2
SCHEMBL1911130 0.78 CYP1A2 (0.34) CYP1A2
SCHEMBL12262014 0.77 SHBG (0.41) DPP4METAP2CYP1A2REN
SCHEMBL12631699 0.77 SHBG (0.41) DPP4METAP2CYP1A2REN
SCHEMBL12262018 0.77 SHBG (0.41) DPP4METAP2CYP1A2REN

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
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
US-20090192148-A1 Organic Compounds NOVARTIS AG (CH) 2009-07-30 — — 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 (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 DPP4 436/4885AKT1 4747/4885METAP2 1473/4885

“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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