SCHEMBL4502906

SCHEMBL4502906

O=C(O)[C@@H]1CNC[C@H](NS(=O)(=O)c2cc(Cl)cc(Cl)c2)C1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
REN P00797 4/20 0.45
TSHR P16473 1/20 0.40
SLC6A11 P48066 1/20 0.40
ALDH1A1 P00352 1/20 0.40
FABP4 P15090 3/20 0.39
ACLY P53396 4/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
HDAC8 Q9BY41 2/20 0.36
STS P08842 1/20 0.36
FLT1 P17948 1/20 0.35
FLT4 P35916 1/20 0.35
KDR P35968 1/20 0.35

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
SCHEMBL4502902 1.00 REN (0.45) RENTSHRSLC6A11ALDH1A1FABP4
SCHEMBL4503629 0.87 HDAC8 (0.50) RENALDH1A1HDAC8
SCHEMBL4503627 0.87 HDAC8 (0.50) RENALDH1A1HDAC8
SCHEMBL4514576 0.86 REN (0.53) RENTSHRSLC6A11ALDH1A1HDAC8
SCHEMBL4514580 0.86 REN (0.53) RENTSHRSLC6A11ALDH1A1HDAC8
SCHEMBL4499006 0.83 REN (0.47) RENTSHRALDH1A1TP53HDAC8
SCHEMBL4499005 0.83 REN (0.47) RENTSHRALDH1A1TP53HDAC8
SCHEMBL4508093 0.82 REN (0.59) RENTSHRSLC6A11ALDH1A1
SCHEMBL4508089 0.82 REN (0.59) RENTSHRSLC6A11ALDH1A1
SCHEMBL1913229 0.80 REN (0.73) RENACLYTP53POLBMAPT

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 REN 1/4885TSHR 933/4885SLC6A11 1122/4885

“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.