SCHEMBL2376296

SCHEMBL2376296

Cc1cc(Cl)c(OCCCO[Si](C)(C)C(C)(C)C)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
HPGD P15428 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MAPK1 P28482 1/20 0.49
KDM4E B2RXH2 5/20 0.42
ALDH1A1 P00352 5/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
DHFR P00374 1/20 0.36
DUT P33316 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
LMNA P02545 2/20 0.34
HTT P42858 1/20 0.34
CYP2D6 P10635 2/20 0.34
CYP1A2 P05177 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP3A4 P08684 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL14804147 0.81 L3MBTL1 (0.56) MAPTHPGDL3MBTL1MAPK1KDM4E
SCHEMBL14804159 0.77 SMN1; SMN2 (0.36) MAPTHPGDL3MBTL1MAPK1ALDH1A1
SCHEMBL14804186 0.74 L3MBTL1 (0.45) MAPTHPGDL3MBTL1KDM4EKMT2A
SCHEMBL13125270 0.74 PLAU (0.56) MAPTHPGDKDM4EALDH1A1KMT2A
SCHEMBL5026682 0.74 PLAU (0.49) KDM4EHTT
SCHEMBL5024222 0.73 ESR1 (0.38) MAPTKDM4EKMT2AMEN1DHFR
SCHEMBL28538333 0.73 DUT (0.43) DUT
SCHEMBL14804133 0.73 MAPT (0.50) MAPTHPGDL3MBTL1MAPK1KDM4E
SCHEMBL13125218 0.73 ESR1 (0.40) MAPTL3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL12243847 0.72 MAPT (0.56) MAPTHPGDL3MBTL1MAPK1KDM4E

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
EP-2376473-A1 3,4 - SUBSTITUTED PIPERIDINE DERIVATIVES AS RENIN INHIBITORS Merck Canada Inc. (CA) 2011-10-19 EP disclosed
US-20110237622-A1 RENIN INHIBITORS MERCK FROSST CANADA LTD. (CA) 2011-09-29 US disclosed
WO-2010066028-A1 3,4 - SUBSTITUTED PIPERIDINE DERIVATIVES AS RENIN INHIBITORS MERCK FROSST CANADA LTD. (CA) 2010-06-17 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-20110237622-A1 RENIN INHIBITORS REN, ACE, ACE2 MAPT 4520/4885HPGD 115/4885L3MBTL1 4872/4885

“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.