SCHEMBL4499004

SCHEMBL4499004

O=C(O)[C@@H]1CNC[C@H](NS(=O)(=O)c2cc(Cl)ccc2Cl)C1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.44
SLC6A11 P48066 1/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MCL1 Q07820 3/20 0.42
HPGD P15428 2/20 0.41
HSD17B10 Q99714 1/20 0.41
TSHR P16473 1/20 0.41
REN P00797 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CNR1 P21554 1/20 0.39
USP2 O75604 1/20 0.39
ACLY P53396 2/20 0.39
GSTO1 P78417 1/20 0.38

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
SCHEMBL4499002 1.00 MAPK1 (0.44) MAPK1SLC6A11ALDH1A1KDM4EMCL1
SCHEMBL4499020 0.90 HDAC8 (0.46) SLC6A11ALDH1A1RENL3MBTL1ACLY
SCHEMBL4499022 0.90 HDAC8 (0.46) SLC6A11ALDH1A1RENL3MBTL1ACLY
SCHEMBL4504903 0.86 ALDH1A1 (0.56) SLC6A11ALDH1A1RENL3MBTL1
SCHEMBL4504905 0.86 ALDH1A1 (0.56) SLC6A11ALDH1A1RENL3MBTL1
SCHEMBL1913228 0.82 REN (0.64) MAPK1ALDH1A1KDM4ERENL3MBTL1
SCHEMBL4514580 0.82 REN (0.53) SLC6A11ALDH1A1KDM4ETSHRREN
SCHEMBL4514576 0.82 REN (0.53) SLC6A11ALDH1A1KDM4ETSHRREN
SCHEMBL4498089 0.81 REN (0.49) SLC6A11ALDH1A1TSHRRENL3MBTL1
SCHEMBL4499005 0.81 REN (0.47) MAPK1ALDH1A1TSHRREN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233920-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-09-17 US claimed
EP-1907359-A2 3,5-SUBSTITUTED PIPERIDINE DERIVATIVES EFFECTIVE ON RENIN-RELATED DISORDERS Novartis AG (CH) 2008-04-09 EP claimed
WO-2007006534-A2 PIPERIDINE DERIVATIVES USEFUL IN THE DIAGNOSTIC AND THERAPEUTIC TREATMENT OF DISEASES DEPENDING ON RENIN ACTIVITY NOVARTIS AG (CH) 2007-01-18 WO claimed
US-20090233920-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-09-17 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-20090233920-A1 ORGANIC COMPOUNDS REN, ACE, AGTR1 MAPK1 3136/4885SLC6A11 1122/4885ALDH1A1 39/4885

“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.