SCHEMBL90227

SCHEMBL90227

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

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
REN P00797 4/20 0.44
ALDH1A1 P00352 4/20 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
SMN1; SMN2 Q16637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 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
SCHEMBL15786429 0.90 REN (0.38) MAPTHPGDTSHRNPSR1REN
SCHEMBL89403 0.90 REN (0.46) MAPTHPGDTSHRNPSR1REN
SCHEMBL89091 0.87 REN (0.46) MAPTHPGDTSHRNPSR1REN
SCHEMBL88801 0.87 MAPT (0.47) MAPTHPGDTSHRNPSR1REN
SCHEMBL13434188 0.86 MAPT (0.46) MAPTHPGDTSHRNPSR1REN
SCHEMBL15087931 0.86 REN (0.42) MAPTHPGDTSHRNPSR1REN
SCHEMBL13091047 0.85 ALDH1A1 (0.47) MAPTHPGDTSHRNPSR1REN
SCHEMBL89417 0.85 REN (0.59) MAPTHPGDTSHRNPSR1REN
SCHEMBL13434196 0.85 MAPT (0.45) MAPTHPGDTSHRNPSR1REN
SCHEMBL89089 0.85 MAPT (0.43) MAPTHPGDTSHRNPSR1REN

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
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

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 MAPT 1089/4885HPGD 723/4885TSHR 1095/4885

“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.