SCHEMBL695665

SCHEMBL695665

COC(=O)c1ccc(OCCOCc2ccccc2OC)cc1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.63
RAB9A P51151 2/20 0.63
L3MBTL1 Q9Y468 4/20 0.62
TDP1 Q9NUW8 1/20 0.62
LMNA P02545 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
HPGD P15428 2/20 0.53
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 1/20 0.53
NPC1 O15118 1/20 0.49
VDR P11473 1/20 0.48
SPHK2 Q9NRA0 1/20 0.47
SPHK1 Q9NYA1 1/20 0.47
RORC P51449 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46

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
SCHEMBL694844 0.88 PKM (0.59) MAPTRAB9AL3MBTL1TDP1LMNA
SCHEMBL695301 0.82 L3MBTL1 (0.54) MAPTRAB9AL3MBTL1LMNASMN1; SMN2
SCHEMBL25686475 0.81 MAPT (0.75) MAPTRAB9AL3MBTL1TDP1LMNA
SCHEMBL14274445 0.80 MAPT (0.89) MAPTRAB9AL3MBTL1TDP1LMNA
SCHEMBL5284759 0.79 MAPT (1.00) MAPTRAB9AL3MBTL1TDP1LMNA
SCHEMBL1951546 0.78 MAPT (1.00) MAPTRAB9AL3MBTL1TDP1LMNA
SCHEMBL11605162 0.76 MEN1 (0.58) MAPTL3MBTL1TDP1LMNASMN1; SMN2
SCHEMBL26627769 0.76 MAPT (0.80) MAPTRAB9AL3MBTL1TDP1LMNA
SCHEMBL21063817 0.76 MAPT (0.80) MAPTRAB9AL3MBTL1TDP1LMNA
SCHEMBL16517520 0.76 TSHR (0.57) MAPTRAB9AL3MBTL1LMNASMN1; SMN2

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-20120115907-A1 NOVEL COMPOUNDS AS INHIBITORS OF RENIN CADILA HEALTHCARE LIMITED (IN) 2012-05-10 US disclosed
EP-2421828-A2 PIPERIDINE DERIVATIVES AS INHIBITORS OF RENIN Cadila Healthcare Limited (IN) 2012-02-29 EP disclosed
WO-2010122580-A2 NOVEL COMPOUNDS AS INHIBITORS OF RENIN CADILA HEALTHCARE LIMITED (IN) 2010-10-28 WO 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-20120115907-A1 NOVEL COMPOUNDS AS INHIBITORS OF RENIN REN, ACE, AGTR1 MAPT 202/4885RAB9A 529/4885L3MBTL1 4879/4885

“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.