SCHEMBL3999920

SCHEMBL3999920

C=C(C)O[SiH2]CCCOC(=O)C(=C)C

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.53
THRB P10828 1/20 0.46
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 3/20 0.39
CA1 P00915 1/20 0.31
CA2 P00918 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
SCHEMBL28365095 0.91 TSHR (0.55) TSHRTHRBPOLBAPEX1HTT
SCHEMBL17727833 0.85 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL5832212 0.85 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL345837 0.84 TSHR (0.55) TSHRTHRBPOLBAPEX1HTT
SCHEMBL1011657 0.83 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL7909992 0.82 TSHR (0.46) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28293056 0.82 TSHR (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL9442335 0.82 TSHR (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL1155455 0.82 TSHR (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28709934 0.81 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1772138-B1 Organopolysiloxane combination for powder surface treatment SHINETSU CHEMICAL CO (JP) 2013-01-16 EP disclosed
US-7862895-B2 Organopolysiloxane combination for surface treatment, powder treated with the combination, and cosmetic comprising the powder SHIN-ETSU CHEMICAL CO., LTD. (JP) 2011-01-04 US disclosed
EP-1618926-B1 HAIR TREATMENT COMPRISING ACRYLIC/SILICONE COPOLYMER AND COSMETIC HAIR PREPARATION CONTAINING THE TREATMENT SHINETSU CHEMICAL CO (JP) 2009-06-03 EP disclosed
EP-1772138-A2 Organopolysiloxane combination for powder surface treatment Shin-Etsu Chemical Company, Ltd. (JP) 2007-04-11 EP disclosed
US-20070071980-A1 Organopolysiloxane combination for surface treatment, powder treated with the combination and cosmetic comprising the power SHIN-ETSU CHEMICAL CO., LTD. 2007-03-29 US disclosed
US-20060198804-A1 Hair treatment comprising acrylic/silicone copolymer and cosmetic hair preparation containing the treatment SHIN-ETSU CHEMICAL CO., LTD. (JP) 2006-09-07 US disclosed
EP-1618926-A1 HAIR TREATMENT COMPRISING ACRYLIC/SILICONE COPOLYMER AND COSMETIC HAIR PREPARATION CONTAINING THE TREATMENT Shin-Etsu Chemical Company, Ltd. (JP) 2006-01-25 EP 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-20060198804-A1 Hair treatment comprising acrylic/silicone copolymer and cosmetic hair preparation containing the treatment SUCLG1, SGMS1, HDAC10 TSHR 3219/4885THRB 2695/4885POLB 1017/4885
US-20070071980-A1 Organopolysiloxane combination for surface treatment, powder treated with the combination and cosmetic comprising the power XPA, COL2A1, MSR1 TSHR 928/4885THRB 1283/4885POLB 956/4885

“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.