SCHEMBL6042357

SCHEMBL6042357

C=CCOc1cc(COC2CN(C(=O)O)CCC2c2ccc(F)cc2)cc2ccccc12

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
REN P00797 7/20 0.34
MAPT P10636 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
POLB P06746 2/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
PTGER1 P34995 2/20 0.33
GYS1 P13807 1/20 0.33
KDM2B Q8NHM5 1/20 0.33
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
EGFR P00533 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 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
SCHEMBL6044005 0.91 KDM2B (0.40) RENMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL6042261 0.89 CCR3 (0.37) RENMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL6041290 0.89 REN (0.39) RENMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL6042512 0.88 REN (0.42) RENLMNAMEN1KMT2A
SCHEMBL6043330 0.87 KDM2B (0.36) RENMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL6042134 0.87 REN (0.39) RENPTGER1HTR2A
SCHEMBL6043715 0.87 REN (0.38) RENMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL6042154 0.87 REN (0.39) RENMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL6042212 0.87 MGLL (0.39) RENMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL6042767 0.86 REN (0.42) RENPTGER1

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 1485/4885MAPT 43/4885RAB9A 1698/4885

“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.