SCHEMBL4502020

SCHEMBL4502020

O=C(Nc1cccc(Cl)c1)N[C@H]1CNC[C@@H](C(=O)O)C1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.60
KMT2A Q03164 5/20 0.60
LMNA P02545 4/20 0.60
NPC1 O15118 4/20 0.60
RAB9A P51151 4/20 0.60
EPHX2 P34913 3/20 0.60
EPHX1 P07099 2/20 0.60
TSHR P16473 1/20 0.60
MAPT P10636 3/20 0.52
HTT P42858 2/20 0.52
ALDH1A1 P00352 2/20 0.52
POLB P06746 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL4502018 1.00 MEN1 (0.60) MEN1KMT2ALMNANPC1RAB9A
SCHEMBL1913238 0.83 CASR (0.52) MEN1KMT2ALMNANPC1RAB9A
SCHEMBL2751657 0.76 RAB9A (0.97) MEN1KMT2ALMNANPC1RAB9A
SCHEMBL12196175 0.75 RAB9A (1.00) MEN1KMT2ALMNANPC1RAB9A
SCHEMBL4495638 0.74 RXFP1 (0.48) EPHX2MAPTALDH1A1POLB
SCHEMBL4495643 0.74 RXFP1 (0.48) EPHX2MAPTALDH1A1POLB
SCHEMBL24342377 0.74 EPHX2 (0.65) KMT2ARAB9AEPHX2EPHX1TSHR
SCHEMBL4503627 0.73 HDAC8 (0.50) LMNAALDH1A1
SCHEMBL4503629 0.73 HDAC8 (0.50) LMNAALDH1A1
SCHEMBL4911807 0.72 LMNA (0.70) MEN1KMT2ALMNANPC1RAB9A

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 MEN1 2386/4885KMT2A 3192/4885LMNA 2165/4885

“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.