SCHEMBL6044005

SCHEMBL6044005

O=C(O)N1CCC(c2ccc(F)cc2)C(OCc2cc(OCc3ccccc3)c3ccccc3c2)C1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 1/20 0.40
MAPT P10636 3/20 0.39
LMNA P02545 2/20 0.39
HPGD P15428 2/20 0.39
POLB P06746 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PTGER1 P34995 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
REN P00797 6/20 0.38
ALDH1A1 P00352 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
KDM1A O60341 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL6042212 0.94 MGLL (0.39) KDM2BMAPTLMNAHPGDPOLB
SCHEMBL6041290 0.94 REN (0.39) KDM2BMAPTLMNAHPGDPOLB
SCHEMBL6042261 0.92 CCR3 (0.37) KDM2BMAPTLMNAHPGDPOLB
SCHEMBL6041246 0.92 KDM2B (0.45) KDM2BMAPTLMNAHPGDPOLB
SCHEMBL6041704 0.92 HTT (0.42) MAPTNPC1RAB9AREN
SCHEMBL6041597 0.91 KDM2B (0.39) KDM2BMAPTLMNAHPGDPOLB
SCHEMBL6043273 0.91 REN (0.42) MAPTLMNAHPGDPOLBNPC1
SCHEMBL6042512 0.91 REN (0.42) LMNARENMEN1KMT2A
SCHEMBL6042864 0.91 REN (0.45) NPC1RAB9APTGER1RENMEN1
SCHEMBL6041832 0.91 REN (0.39) MAPTLMNAHPGDPOLBNPC1

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 KDM2B 2244/4885MAPT 43/4885LMNA 380/4885

“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.