SCHEMBL89403

SCHEMBL89403

Cc1ccc2c(c1)N(CCCN)C(=O)C(C)(C)O2

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
REN P00797 6/20 0.46
MAPT P10636 2/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALDH1A1 P00352 3/20 0.42
RECQL P46063 1/20 0.42
POLB P06746 6/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.40
ALOX15 P16050 1/20 0.40
TP53 P04637 1/20 0.39
GAA P10253 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
SCHEMBL90227 0.90 MAPT (0.44) RENMAPTHPGDTSHRNPSR1
SCHEMBL89091 0.87 REN (0.46) RENMAPTHPGDTSHRNPSR1
SCHEMBL88801 0.87 MAPT (0.47) RENMAPTHPGDTSHRNPSR1
SCHEMBL13434188 0.86 MAPT (0.46) RENMAPTHPGDTSHRNPSR1
SCHEMBL13091047 0.85 ALDH1A1 (0.47) RENMAPTHPGDTSHRNPSR1
SCHEMBL89417 0.85 REN (0.59) RENMAPTHPGDTSHRNPSR1
SCHEMBL89089 0.85 MAPT (0.43) RENMAPTHPGDTSHRNPSR1
SCHEMBL13434196 0.85 MAPT (0.45) RENMAPTHPGDTSHRNPSR1
SCHEMBL89090 0.84 MAPT (0.48) RENMAPTHPGDTSHRNPSR1
SCHEMBL13434190 0.84 REN (0.56) RENMAPTHPGDTSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2420491-B1 3 , 5-SUBSTITUED PIPERIDINE COMPOUNDS AS RENIN INHIBITORS NOVARTIS AG (CH) 2013-07-03 EP disclosed
US-8129411-B2 Organic compounds NOVARTIS AG (CH) 2012-03-06 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 REN 1/4885MAPT 1089/4885HPGD 723/4885

“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.