SCHEMBL12634752

SCHEMBL12634752

CC(C)(C)[Si](C)(C)OCCOc1ccccc1CCO

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 2/20 0.36
MAPK1 P28482 1/20 0.36
CSNK1A1 P48729 1/20 0.36
CSNK1D P48730 1/20 0.36
PRKCD Q05655 1/20 0.36
PAK1 Q13153 1/20 0.36
CAMK2B Q13554 1/20 0.36
CAMK2G Q13555 1/20 0.36
CAMK2D Q13557 1/20 0.36
TAOK1 Q7L7X3 1/20 0.36
ALDH1A1 P00352 2/20 0.35
PPARD Q03181 1/20 0.34
DHFR P00374 1/20 0.34
JAK2 O60674 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
DUT P33316 1/20 0.34

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
SCHEMBL4295990 0.88 KDM4E (0.46) MAPTNPSR1L3MBTL1KDM4EMAPK1
SCHEMBL14942972 0.81 ELANE (0.39) MAPTNPSR1L3MBTL1KDM4EMAPK1
SCHEMBL17243934 0.81 ELANE (0.39) MAPTNPSR1L3MBTL1KDM4EMAPK1
SCHEMBL28431669 0.81 MEN1 (0.39) NPSR1KDM4EMAPK1LMNAGAA
SCHEMBL31071747 0.81 L3MBTL1 (0.47) L3MBTL1PPARD
SCHEMBL7438547 0.80 NPSR1 (0.36) NPSR1ALDH1A1HTT
SCHEMBL24977254 0.79 PPARD (0.42) MAPTNPSR1L3MBTL1KDM4EALDH1A1
Lithium Ion SCHEMBL28472504 0.79 L3MBTL1 (0.39) MAPTNPSR1L3MBTL1KDM4EALDH1A1
SCHEMBL20294518 0.79 KDM4E (0.41) MAPTNPSR1L3MBTL1KDM4EMAPK1
SCHEMBL13552200 0.78 NQO2 (0.46) NPSR1LMNAHTT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110105389-A1 Macrocyclic Ghrelin Receptor Antagonists and Inverse Agonists and Methods of Using the Same OCERA THERAPEUTICS, INC. 2011-05-05 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-20110105389-A1 Macrocyclic Ghrelin Receptor Antagonists and Inverse Agonists and Methods of Using the Same GHSR, GHRHR, GIPR MAPT 4659/4885NPSR1 167/4885L3MBTL1 892/4885

“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.