SCHEMBL9622173

SCHEMBL9622173

O[Si](O)(C1CCCCCC1)C1CCCCCC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.35
ALDH1A1 P00352 3/20 0.35
CYP3A4 P08684 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
KDM4E B2RXH2 1/20 0.35
EPHX2 P34913 1/20 0.35
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
TSHR P16473 1/20 0.33
SIGMAR1 Q99720 1/20 0.31
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL9622146 1.00 EPHX1 (0.35) EPHX1ALDH1A1CYP3A4NPC1RAB9A
SCHEMBL2192326 1.00 EPHX1 (0.35) EPHX1ALDH1A1CYP3A4NPC1RAB9A
SCHEMBL7073146 1.00 EPHX1 (0.35) EPHX1ALDH1A1CYP3A4NPC1RAB9A
SCHEMBL9622157 0.96 TSHR (0.35) EPHX1ALDH1A1CYP3A4NPC1RAB9A
SCHEMBL9622668 0.89
SCHEMBL9622195 0.81
SCHEMBL6114649 0.79 HDAC8 (0.33) EPHX1ALDH1A1CES2CES1TSHR
SCHEMBL9622434 0.79 CES2 (0.33) EPHX1ALDH1A1CES2CES1TSHR
Cyclohexylsilanetriol SCHEMBL78580 0.79 CES2 (0.33) EPHX1ALDH1A1CES2CES1TSHR
SCHEMBL9622673 0.79 CES2 (0.33) EPHX1ALDH1A1CES2CES1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5106959-A Intermediates for ceramics, gels, films, optical fibers, polymerization catalysts and silicone curing agents RHONE-POULENC, INC. (US) 1992-04-21 US disclosed
US-5099006-A ompounds for use in paints, for waterproofing, as adhesion promoters, mordants, sizing agents and intermediates RHONE-POULENC INC. (US) 1992-03-24 US disclosed
US-5017694-A With silanol-type compounds RHONE-POULENC, INC. (US) 1991-05-21 US disclosed
US-5017695-A With cerium ammonium nitrate and silanol-type compound RHONE-POULENC, INC. (US) 1991-05-21 US disclosed
EP-0319383-A2 Process for the fabrication of cerium hydrocarbonsilyloxides by transetherification of cerium alkoxides RHONE-POULENC CHIMIE (FR) 1989-06-07 EP disclosed
EP-0319384-A2 Cerium hydrocarbonsilyloxydes and process for their manufacture RHONE-POULENC CHIMIE (FR) 1989-06-07 EP disclosed