SCHEMBL6042484

SCHEMBL6042484

C=CCOc1ccc(C2CCN(C(=O)O)CC2OCc2ccc3ccccc3c2OCOCCOC)cc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
REN P00797 12/20 0.33
MTNR1A P48039 1/20 0.33
POLB P06746 1/20 0.32
MMP13 P45452 1/20 0.31
MAPT P10636 2/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL6042443 0.95 REN (0.35) RENMTNR1APOLBMMP13MAPT
SCHEMBL6041853 0.90 REN (0.33) REN
SCHEMBL6043104 0.84 REN (0.33) REN
SCHEMBL6042439 0.81 MAPT (0.42) RENMAPTNPC1RAB9A
SCHEMBL7076917 0.81 REN (0.33) RENMTNR1A
SCHEMBL6041261 0.81 REN (0.41) RENNPC1RAB9A
SCHEMBL6043265 0.80 SMN1; SMN2 (0.33) RENPOLBMMP13MAPTRAB9A
SCHEMBL6041417 0.80 PDCD1 (0.41) REN
SCHEMBL6042683 0.80 REN (0.34) REN
SCHEMBL6043060 0.79 REN (0.49) REN

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-20060079533-A1 Methods of treating alzheimer's disease NIEMAN JAMES A 2006-04-13 US disclosed
US-6150526-A Piperidine derivative having renin inhibiting activity HOFFMANN-LA ROCHE INC. (US) 2000-11-21 US disclosed
US-6051712-A PREVENTION OF HIGH BLOOD PRESSURE AND CARDIAC INSUFFICIENCY, AS WELL AS GLAUCOMA, CARDIAC INFARCT, KIDNEY INSUFFICIENCY AND RESTENOSIS HOFFMANN-LA ROCHE INC. (US) 2000-04-18 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-20060079533-A1 Methods of treating alzheimer's disease BACE1, PSEN1, PSEN2 REN 1485/4885MTNR1A 117/4885POLB 952/4885

“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.