SCHEMBL10180372

SCHEMBL10180372

CCOC(=O)CCCSCCC[Si](OCC)(OCC)OCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.44
HPGD P15428 3/20 0.41
PTGDR2 Q9Y5Y4 3/20 0.40
ALDH1A1 P00352 4/20 0.40
TSHR P16473 3/20 0.39
ABL1 P00519 2/20 0.39
RIN1 Q13671 2/20 0.39
NR1I2 O75469 1/20 0.37
PGR P06401 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
PTGS2 P35354 1/20 0.37
PDE4D Q08499 1/20 0.37
TDP1 Q9NUW8 3/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 2/20 0.37
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
CYP3A4 P08684 2/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL8517434 0.86 CYP1A2 (0.53) CYP1A2HPGDALDH1A1TSHRNR1I2
SCHEMBL10179014 0.85 ALDH1A1 (0.39) HPGDALDH1A1TSHRKDM4EGAA
SCHEMBL11878749 0.84 CYP1A2 (0.52) CYP1A2ALDH1A1TSHRNR1I2PGR
SCHEMBL10178711 0.84 PLA2G4B (0.37) CYP1A2ALDH1A1TSHRTDP1KDM4E
SCHEMBL9109410 0.84 CYP1A2 (0.59) CYP1A2ALDH1A1TSHRABL1RIN1
SCHEMBL10180281 0.83 PLA2G4B (0.39) TSHRHSD17B10
SCHEMBL10178984 0.81 TSHR (0.32) ALDH1A1TSHRTDP1KDM4ELMNA
SCHEMBL13415764 0.81 MAPT (0.32) HPGDPTGDR2ALDH1A1TSHRABL1
SCHEMBL10178811 0.81 TSHR (0.39) HPGDALDH1A1TSHRABL1RIN1
SCHEMBL83049 0.80

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 CYP1A2 466/4885HPGD 924/4885PTGDR2 3690/4885

“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.