SCHEMBL3330801

SCHEMBL3330801

CCCCCCCCCCCCCCCCCCO[Si](=O)OO[SiH3]

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 8/20 0.35
CA2 P00918 8/20 0.35
CA9 Q16790 7/20 0.35
LPAR3 Q9UBY5 3/20 0.35
CA12 O43570 3/20 0.35
CA7 P43166 3/20 0.35
CA14 Q9ULX7 3/20 0.35
LPAR1 Q92633 2/20 0.35
LPAR2 Q9HBW0 2/20 0.35
CA3 P07451 2/20 0.35
CA4 P22748 2/20 0.35
CA6 P23280 2/20 0.35
CA5A P35218 2/20 0.35
CA5B Q9Y2D0 2/20 0.35
NAAA Q02083 1/20 0.35
DGKA P23743 1/20 0.35
RECQL P46063 2/20 0.34
CES2 O00748 1/20 0.34
GLA P06280 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL7205632 0.98 CA1 (0.33) CA1CA2CA9LPAR3CA12
SCHEMBL2781039 0.83 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL2537728 0.83 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL543795 0.83 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL5144532 0.83 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL76191 0.83 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL9895425 0.82 CA1 (0.36) CA1CA2CA9LPAR3CA12
SCHEMBL3097694 0.80 CA1 (0.41) CA1CA2CA9LPAR3CA12
SCHEMBL8837209 0.77 CA1 (0.39) CA1CA2CA9LPAR3CA12
SCHEMBL76345 0.73 CYP3A4 (0.42) CA1CA2CA9HPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010023235-A1 Heat-mediated conditioning from shampoo and conditioner hair care compositions containing silicone CRUDELE JOANNE (US) 2001-09-20 US claimed
EP-1019014-A2 SHAMPOO AND CONDITIONER HAIR CARE RINSE-OFF COMPOSITIONS CONTAINING SILICONE UNILEVER PLC (GB) 2000-07-19 EP claimed
US-5968286-A APPLYING PROTECTIVE COATING IMPROVES SOFTNESS, LUSTER, AND COMBING HELENE CURTIS, INC. (US) 1999-10-19 US claimed
WO-1999017713-A2 SHAMPOO AND CONDITIONER HAIR CARE RINSE-OFF COMPOSITIONS CONTAINING SILICONE UNILEVER PLC (GB) 1999-04-15 WO claimed
US-8821841-B2 Copolymers for cosmetic applications BASF SE (DE) 2014-09-02 US disclosed
US-20130236397-A1 HAIR SETTING COMPOSITIONS BASED ON T-BUTYL ACRYLATE AND HYDROXYALKYL METHACRYLATE BASF SE (DE) 2013-09-12 US disclosed
US-20100135918-A1 COPOLYMERS FOR COSMETIC APPLICATIONS BASF SE (DE) 2010-06-03 US disclosed
US-20090162295-A1 SETTING POLYMERS BASED ON POLYESTER ACRYLATES BASF AKTIENGESELLSCHAFT (DE) 2009-06-25 US disclosed
US-20080260658-A1 Hair Setting Compositions Based on T-Butyl Acrylate and Hydroxyalkyl Methacrylate BASF SE (DE) 2008-10-23 US disclosed
US-20010023235-A1 Heat-mediated conditioning from shampoo and conditioner hair care compositions containing silicone CRUDELE JOANNE (US) 2001-09-20 US disclosed
US-6211125-B1 Heat-mediated conditioning from shampoo and conditioner hair care compositions containing silicone HELENE CURTIS, INC. 2001-04-03 US disclosed
EP-1019014-A2 SHAMPOO AND CONDITIONER HAIR CARE RINSE-OFF COMPOSITIONS CONTAINING SILICONE UNILEVER PLC (GB) 2000-07-19 EP disclosed
EP-1019012-A1 LEAVE-ON HAIR CARE COMPOSITIONS CONTAINING SILICONE UNILEVER PLC (GB) 2000-07-19 EP disclosed
US-6056946-A Heat-mediated conditioning from leave-on hair care compositions containing silicone HELENE CURTIS, INC. (US) 2000-05-02 US disclosed
US-5968286-A APPLYING PROTECTIVE COATING IMPROVES SOFTNESS, LUSTER, AND COMBING HELENE CURTIS, INC. (US) 1999-10-19 US disclosed
WO-1999017713-A2 SHAMPOO AND CONDITIONER HAIR CARE RINSE-OFF COMPOSITIONS CONTAINING SILICONE UNILEVER PLC (GB) 1999-04-15 WO disclosed
WO-1999017719-A1 HEAT-MEDIATED CONDITIONING FROM LEAVE-ON HAIR CARE COMPOSITIONS CONTAINING SILICONE UNILEVER PLC (GB) 1999-04-15 WO 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 (4 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-20130236397-A1 HAIR SETTING COMPOSITIONS BASED ON T-BUTYL ACRYLATE AND HYDROXYALKYL METHACRYLATE MTR, ABHD10, ACR CA1 4081/4885CA2 3841/4885CA9 4132/4885
US-20080260658-A1 Hair Setting Compositions Based on T-Butyl Acrylate and Hydroxyalkyl Methacrylate MTR, ABHD10, ACR CA1 4081/4885CA2 3841/4885CA9 4132/4885
US-20100135918-A1 COPOLYMERS FOR COSMETIC APPLICATIONS CUTA, ACMSD, FFAR3 CA1 3344/4885CA2 4210/4885CA9 3869/4885
US-20090162295-A1 SETTING POLYMERS BASED ON POLYESTER ACRYLATES PAM, COASY, ACSL3 CA1 4388/4885CA2 4118/4885CA9 4128/4885

“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.