SCHEMBL89392

SCHEMBL89392

CCCOCCN1C(=O)C(C)(C)Oc2ccc(C)cc21

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
ALDH1A1 P00352 2/20 0.45
RECQL P46063 1/20 0.45
REN P00797 6/20 0.44
USP2 O75604 2/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALOX15 P16050 1/20 0.42
POLB P06746 3/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL89408 0.91 ALDH1A1 (0.48) MAPTALDH1A1RECQLRENUSP2
SCHEMBL13091047 0.87 ALDH1A1 (0.47) MAPTALDH1A1RECQLRENUSP2
SCHEMBL89102 0.86 REN (0.51) MAPTALDH1A1RECQLRENUSP2
SCHEMBL89091 0.84 REN (0.46) MAPTALDH1A1RECQLRENUSP2
SCHEMBL89093 0.83 POLB (0.47) MAPTALDH1A1RECQLRENUSP2
SCHEMBL89417 0.81 REN (0.59) MAPTALDH1A1RECQLRENUSP2
SCHEMBL13434192 0.81 ALDH1A1 (0.43) MAPTALDH1A1RECQLRENUSP2
SCHEMBL89090 0.81 MAPT (0.48) MAPTALDH1A1RECQLRENUSP2
SCHEMBL13434190 0.81 REN (0.56) MAPTALDH1A1RECQLRENHPGD
SCHEMBL90732 0.80 ALDH1A1 (0.44) MAPTALDH1A1RECQLRENUSP2

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 1089/4885ALDH1A1 38/4885RECQL 657/4885

“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.