SCHEMBL10529239

SCHEMBL10529239

CCCCCCCCCCC(N)(CCCCCCCCCC)CCCC[Si](OC)(OC)OC

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
SMPD1 P17405 5/20 0.37
FDPS P14324 2/20 0.36
SPHK2 Q9NRA0 3/20 0.33
SPHK1 Q9NYA1 1/20 0.33
TNNC1 P63316 5/20 0.31
S1PR1 P21453 2/20 0.31
SGPL1 O95470 1/20 0.31
S1PR4 O95977 1/20 0.31
GPR183 P32249 1/20 0.31
CERS2 Q96G23 1/20 0.31
S1PR3 Q99500 1/20 0.31
S1PR5 Q9H228 1/20 0.31
TSHR P16473 1/20 0.31
THRB P10828 1/20 0.31
GGPS1 O95749 1/20 0.31

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
SCHEMBL2710658 0.96 LMNA (0.50) LMNASMPD1FDPSSPHK2SPHK1
Fluoride SCHEMBL10882602 0.94 LMNA (0.49) LMNASMPD1FDPSSPHK2SPHK1
Hydrochloric Acid SCHEMBL10611254 0.94 LMNA (0.49) LMNASMPD1FDPSSPHK2SPHK1
Hydrochloric Acid SCHEMBL766241 0.94 LMNA (0.49) LMNASMPD1FDPSSPHK2SPHK1
Hydrochloric Acid SCHEMBL1335628 0.85 LMNA (0.41) LMNA
SCHEMBL4433953 0.84 LMNA (0.40) LMNA
SCHEMBL20210773 0.83 LMNA (0.36) LMNA
SCHEMBL304612 0.83 LMNA (0.65) LMNATSHRTHRB
SCHEMBL1780545 0.83 LMNA (0.65) LMNATSHRTHRB
Hexane SCHEMBL6049081 0.83 LMNA (0.65) LMNATSHRTHRB

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-0265509-A4 AN ANTIMICROBIALLY ACTIVE WET WIPER. JAMES RIVER CORP (US) 1989-10-11 EP disclosed
EP-0265509-A1 AN ANTIMICROBIALLY ACTIVE WET WIPER JAMES RIVER CORPORATION (US) 1988-05-04 EP disclosed
WO-1987006470-A1 AN ANTIMICROBIALLY ACTIVE WET WIPER JAMES RIVER CORPORATION (US) 1987-11-05 WO disclosed