SCHEMBL6137281

SCHEMBL6137281

C#CC(COc1ccccc1)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.42
LMNA P02545 1/20 0.40
MAOA P21397 2/20 0.37
PTGS1 P23219 1/20 0.37
MTNR1A P48039 3/20 0.37
MTNR1B P49286 3/20 0.37
SCN4A P35499 2/20 0.36
KDM1A O60341 1/20 0.35
MAOB P27338 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34
KDM4E B2RXH2 1/20 0.33
SLC22A2 O15244 1/20 0.33
SLC22A1 O15245 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
SCHEMBL6137275 1.00 CYP2D6 (0.42) CYP2D6LMNAMAOAPTGS1MTNR1A
SCHEMBL9794052 1.00 CYP2D6 (0.42) CYP2D6LMNAMAOAPTGS1MTNR1A
SCHEMBL6317914 0.86 TSHR (0.35) CYP2D6CYP1A2CYP2C19L3MBTL1ALDH1A1
SCHEMBL6317906 0.86 TSHR (0.35) CYP2D6CYP1A2CYP2C19L3MBTL1ALDH1A1
SCHEMBL3147800 0.84 CASR (0.39) LMNAKCNH2SMN1; SMN2
SCHEMBL3147814 0.84 CASR (0.39) LMNAKCNH2SMN1; SMN2
SCHEMBL3140717 0.82 L3MBTL1 (0.43) LMNAMAOAMAOBL3MBTL1KDM4E
SCHEMBL3140731 0.82 L3MBTL1 (0.43) LMNAMAOAMAOBL3MBTL1KDM4E
SCHEMBL10700080 0.79 LMNA (0.42) CYP2D6LMNAMAOAPTGS1MTNR1A
SCHEMBL6137571 0.79 MAOB (0.40) CYP2D6MAOAMAOBCYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1436252-A4 HYDROXYFATTYSULFONIC ACID ANALOGS TAISHO PHARMACEUTICAL CO LTD (JP) 2005-02-09 EP disclosed
US-20050020680-A1 Hydroxyfattysulfonic acid analogs BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2005-01-27 US disclosed
EP-1436252-A1 HYDROXYFATTYSULFONIC ACID ANALOGS TAISHO PHARMACEUTICAL CO., LTD (JP) 2004-07-14 EP disclosed
WO-2003024922-A1 HYDROXYFATTYSULFONIC ACID ANALOGS TAISHO PHARMACEUTICAL CO., LTD. (JP) 2003-03-27 WO disclosed
US-4983627-A Treating atherosclerosis, thrombosis and vasospasms; anticholesterol,-secretory,-ulcer and hypotensive agents SYNTEX (U.S.A.) INC. (US) 1991-01-08 US disclosed
US-4735966-A ANTICOAGULANTS, VASODILATORS, HYPOTENSIVE AND ANTICHOLESTEROL AGENTS SYNTEX (U.S.A.) INC. (US) 1988-04-05 US disclosed
EP-0257609-A2 Novel substituted (4.2.0)Bicyclooctane derivatives with valuable therapeutic properties SYNTEX (U.S.A.) INC. (US) 1988-03-02 EP 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-20050020680-A1 Hydroxyfattysulfonic acid analogs ELANE, HRH2, APEH CYP2D6 481/4885LMNA 3284/4885MAOA 1166/4885

“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.