SCHEMBL10178702

SCHEMBL10178702

CCO[Si](CCCSCCC(=O)OCC[N+](C)(C)C)(OCC)OCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.47
ADRA1A P35348 1/20 0.47
MAPT P10636 1/20 0.46
BLM P54132 1/20 0.46
ACHE P22303 5/20 0.40
CYP2C19 P33261 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
CHRM5 P08912 6/20 0.37
CHRM1 P11229 6/20 0.37
CHRM3 P20309 6/20 0.37
CHRM2 P08172 5/20 0.37
CHRM4 P08173 5/20 0.37
CHRNB2 P17787 4/20 0.37
CHRNA4 P43681 4/20 0.37
CHRNA7 P36544 3/20 0.37
HTR1A P08908 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
PGR P06401 1/20 0.37
TBXA2R P21731 1/20 0.37
CHRNB4 P30926 1/20 0.37

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
SCHEMBL10178711 0.89 PLA2G4B (0.37) LMNATSHRHSD17B10
SCHEMBL10180281 0.87 PLA2G4B (0.39) TSHRHSD17B10
SCHEMBL13260890 0.86 ADRA2A (0.50) ADRA2AADRA1AMAPTBLMACHE
SCHEMBL10180339 0.83 DNM1 (0.48) MAPTBLMCYP2C19CHRM5CHRM1
SCHEMBL10178769 0.82 DGKA (0.40) MAPTLMNATSHRHSD17B10
SCHEMBL10180372 0.80 CYP1A2 (0.44) MAPTCYP2C19L3MBTL1PGRLMNA
SCHEMBL10178811 0.80 TSHR (0.39) L3MBTL1LMNATSHRRAB9AHSD17B10
SCHEMBL3421547 0.80 PDE1A (0.39) HSD17B10
SCHEMBL10178886 0.80 HSD17B10 (0.37) HSD17B10
SCHEMBL10178984 0.80 TSHR (0.32) LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119710-B2 Filled rubber compounds with improved processability BASF SE (DE) 2012-02-21 US disclosed
US-20100317778-A1 Filled Rubber Compounds with Improved Processability CIBA CORPORATION 2010-12-16 US disclosed
US-7723409-B2 Coupling agents between filler and elastomer CIBA SPECIALTY CHEM. CORP. (US) 2010-05-25 US disclosed
US-20080287578-A1 Coupling Agents Between Filler and Elastomer CIBA SPECIALTY CHEMICALS CORP. 2008-11-20 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-20100317778-A1 Filled Rubber Compounds with Improved Processability RER1, RIF1, REV1 ADRA2A 2558/4885ADRA1A 1641/4885MAPT 2735/4885

“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.