SCHEMBL5085692

SCHEMBL5085692

CC[Si](CC)(CC)NCCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.54
ATM Q13315 1/20 0.54
SIGMAR1 Q99720 8/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
KDM1A O60341 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
HTR1A P08908 1/20 0.48
ADRA2A P08913 1/20 0.48
CYP2C8 P10632 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
IDO1 P14902 1/20 0.48
TSHR P16473 1/20 0.48
NFKB1 P19838 1/20 0.48
MAOA P21397 1/20 0.48

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
SCHEMBL6560133 0.78 ATM (0.58) TAAR1ATMSIGMAR1NPC1RAB9A
SCHEMBL11097946 0.76 SIGMAR1 (0.42) TAAR1ATMSIGMAR1CYP3A4L3MBTL1
SCHEMBL26964152 0.72 ATM (0.50) TAAR1ATMSIGMAR1NPC1RAB9A
SCHEMBL28453487 0.71 TP53 (0.46) TAAR1ATMSIGMAR1ALDH1A1LMNA
SCHEMBL1406143 0.71 SIGMAR1 (0.64) TAAR1ATMSIGMAR1NPC1RAB9A
SCHEMBL9768698 0.71 SIGMAR1 (0.58) TAAR1ATMSIGMAR1NPC1RAB9A
SCHEMBL11103634 0.71 SIGMAR1 (0.44) TAAR1ATMSIGMAR1NPC1RAB9A
SCHEMBL16415958 0.70 NPC1 (0.58) TAAR1ATMSIGMAR1NPC1RAB9A
SCHEMBL1878 0.70 TAAR1 (1.00) TAAR1ATMSIGMAR1NPC1RAB9A
SCHEMBL19355275 0.70 TAAR1 (1.00) TAAR1ATMSIGMAR1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1624851-B1 HAIR CARE APPLICATIONS OF EMULSIONS CONTAINING ELASTOMERIC SILANES AND SILOXANES WITH NITROGEN ATOMS DOW CORNING (US) 2014-05-28 EP disclosed
US-7902293-B2 Method of preparing emulsions containing elastomeric silanes and siloxanes having quaternary ammonium groups DOW CORNING CORPORATION (US) 2011-03-08 US disclosed
EP-1625132-B1 METHOD OF PREPARING EMULSIONS CONTAINING ELASTOMERIC SILANES AND SILOXANES HAVING QUATERNARY AMMONIUM GROUPS DOW CORNING (US) 2008-08-13 EP disclosed
US-20060269506-A1 Personal care applications of emulsions containing elastomeric silanes and siloxanes with nitrogen atoms DOW CORNING CORPORATION (US) 2006-11-30 US disclosed
US-20060193805-A1 Method of preparing emulsions containing elastomeric silanes and siloxanes having quaternary ammonium groups DOW SILICONES CORPORATION 2006-08-31 US disclosed
EP-1426398-B1 Method of making emulsion containing quaternary ammonium functional silanes and siloxanes DOW CORNING (US) 2006-07-05 EP disclosed
EP-1624851-A1 PERSONAL CARE APPLICATIONS OF EMULSIONS CONTAINING ELASTOMERIC SILANES AND SILOXANES WITH NITROGEN ATOMS Dow Corning Corporation (US) 2006-02-15 EP disclosed
EP-1625132-A1 METHOD OF PREPARING EMULSIONS CONTAINING ELASTOMERIC SILANES AND SILOXANES HAVING QUATERNARY AMMONIUM GROUPS Dow Corning Corporation (US) 2006-02-15 EP disclosed
WO-2004103326-A1 PERSONAL CARE APPLICATIONS OF EMULSIONS CONTAINING ELASTOMERIC SILANES AND SILOXANES WITH NITROGEN ATOMS DOW CORNING CORPORATION (US) 2004-12-02 WO disclosed
WO-2004104013-A1 METHOD OF PREPARING EMULSIONS CONTAINING ELASTOMERIC SILANES AND SILOXANES HAVING QUATERNARY AMMONIUM GROUPS DOW CORNING CORPORATION (US) 2004-12-02 WO disclosed
US-6787603-B2 REACTING EPOXIDE OR HALOHYDRIN DERIVATIZED NITROGEN ONIUM COMPOUND WITH AN AMINO FUNCTIONALIZED POLYSILOXANE IN WATER CONTAINING SURFACTANT DOW CORNING CORPORATION 2004-09-07 US disclosed
EP-1426398-A1 Method of making emulsion containing quaternary ammonium functional silanes and siloxanes DOW CORNING CORPORATION (US) 2004-06-09 EP disclosed
US-20040102570-A1 METHOD OF MAKING EMULSION CONTAINING QUATERNARY AMMONIUM FUNCTIONAL SILANES AND SILOXANES DOW SILICONES CORPORATION 2004-05-27 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 (2 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-20060193805-A1 Method of preparing emulsions containing elastomeric silanes and siloxanes having quaternary ammonium groups COPE, ITCH, CUTA TAAR1 2944/4885ATM 2800/4885SIGMAR1 1471/4885
US-20060269506-A1 Personal care applications of emulsions containing elastomeric silanes and siloxanes with nitrogen atoms CUTA, POLR1C, ITCH TAAR1 2778/4885ATM 2906/4885SIGMAR1 791/4885

“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.