SCHEMBL6041666

SCHEMBL6041666

COc1cc(COC2CN(C(=O)O)CCC2c2ccc(OCc3cnc(-c4ccccc4)o3)cc2)c(OC)c2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
REN P00797 4/20 0.45
SSTR5 P35346 4/20 0.36
NPC1 O15118 8/20 0.35
RAB9A P51151 8/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PDCD1 Q15116 2/20 0.33
CD274 Q9NZQ7 2/20 0.33
HSP90AA1 P07900 1/20 0.33
PPARG P37231 2/20 0.32
PPARA Q07869 1/20 0.32

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
SCHEMBL7084998 0.89 REN (0.42) RENSSTR5NPC1RAB9APDCD1
SCHEMBL6042111 0.88 REN (0.45) RENNPC1RAB9AMEN1KMT2A
SCHEMBL6041418 0.88 REN (0.45) RENSSTR5NPC1RAB9APDCD1
SCHEMBL6043793 0.84 REN (0.56) RENSSTR5NPC1RAB9AKMT2A
SCHEMBL6041644 0.84 REN (0.58) RENSSTR5NPC1RAB9A
SCHEMBL6041562 0.83 REN (0.64) REN
SCHEMBL6041262 0.83 REN (0.49) RENSSTR5
SCHEMBL6042470 0.83 REN (0.47) RENSSTR5MEN1KMT2A
SCHEMBL6042125 0.82 REN (0.58) RENSSTR5PPARGPPARA
SCHEMBL6043060 0.82 REN (0.49) RENSSTR5

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-20060079533-A1 Methods of treating alzheimer's disease NIEMAN JAMES A 2006-04-13 US disclosed
WO-2002076440-A2 METHODS OF TREATING ALZHEIMER'S DISEASE WITH PIPERIDIN DERIVATES ELAN PHARMACEUTICALS, INC. (US) 2002-10-03 WO 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 1485/4885SSTR5 2649/4885NPC1 418/4885

“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.