SCHEMBL10053743

SCHEMBL10053743

CCCC1CCC(C)C(O)C1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA4 P22748 2/20 0.39
CYP2C9 P11712 1/20 0.34
LMNA P02545 2/20 0.33
MAPK1 P28482 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HTT P42858 1/20 0.32
GBA1 P04062 1/20 0.31
FYN P06241 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
SCHEMBL12279488 1.00 CA1 (0.39) CA1CA2CA4CYP2C9LMNA
SCHEMBL21773610 1.00 CA1 (0.39) CA1CA2CA4CYP2C9LMNA
SCHEMBL10158419 0.88 LMNA (0.44) CA1CA2CA4LMNAMAPK1
SCHEMBL17827044 0.88 LMNA (0.44) CA1CA2CA4LMNAMAPK1
SCHEMBL12166770 0.83 CA1 (0.39) CA1CA2CA4CYP2C9LMNA
SCHEMBL12833131 0.82 CA1 (0.41) CA1CA2CA4CYP2C9LMNA
SCHEMBL15241789 0.82 CA1 (0.39) CA1CA2CA4
SCHEMBL12166548 0.82 CA1 (0.39) CA1CA2CA4
SCHEMBL19197712 0.82 CA1 (0.39) CA1CA2CA4
SCHEMBL16948272 0.82 CA1 (0.39) CA1CA2CA4

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 126 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242842-A1 TREATMENT COMPOSITIONS PROCTER & GAMBLE (US) 2023-08-03 US disclosed
US-20230242842-A1 TREATMENT COMPOSITIONS PROCTER & GAMBLE (US) 2023-08-03 US disclosed
CN-114514986-B Method for regulating and controlling exogenous flavor of sauced duck neck 三只松鼠股份有限公司 2023-06-27 CN disclosed
EP-3774995-B1 SILOXANES FOR THE TREATMENT OF TEXTILES AND FOR THEIR USE IN CLEANING AND CARE FORMULATIONS EVONIK OPERATIONS GMBH (DE) 2023-06-21 EP disclosed
CN-114514986-A Method for regulating and controlling exogenous flavor of sauced duck neck 三只松鼠股份有限公司 2022-05-20 CN disclosed
EP-2831178-B1 LOW VISCOSITY POLYORGANOSILOXANES COMPRISING QUATERNARY AMMONIUM GROUPS, METHODS FOR THE PRODUCTION AND THE USE THEREOF (ll) MOMENTIVE PERFORMANCE MAT GMBH (DE) 2020-07-22 EP disclosed
EP-3204455-B1 HYDROPHILIC ETHYLENE OXIDE FREE EMULSIFIER COMPRISING DENDRIMERIC POLYHYDROXYLATED ESTER MOIETIES MOMENTIVE PERFORMANCE MAT GMBH (DE) 2020-04-29 EP disclosed
EP-3199592-B1 LOW VISCOSITY POLYORGANOSILOXANES COMPRISING QUATERNARY AMMONIUM GROUPS, METHODS FOR THE PRODUCTION AND THE USE THEREOF MOMENTIVE PERFORMANCE MAT GMBH (DE) 2020-02-26 EP disclosed
EP-3357973-B1 LOW VISCOSITY POLYORGANOSILOXANES COMPRISING QUATERNARY AMMONIUM GROUPS, METHODS FOR THE PRODUCTION AND THE USE THEREOF (II) MOMENTIVE PERFORMANCE MAT GMBH (DE) 2019-07-31 EP disclosed
EP-3357973-A1 LOW VISCOSITY POLYORGANOSILOXANES COMPRISING QUATERNARY AMMONIUM GROUPS, METHODS FOR THE PRODUCTION AND THE USE THEREOF (II) Momentive Performance Materials GmbH (DE) 2018-08-08 EP disclosed
US-7897716-B2 Polyorganosiloxane compositions for the treatment of substrates MOMENTIVE PERFORMANCE MATERIALS GMBH (DE) 2011-03-01 US disclosed
US-20110045186-A1 Polyhedral Oligomeric Silsesquioxane Image Conditioning Coating XEROX CORPORATION (US) 2011-02-24 US disclosed
US-20110037012-A1 Use Of Polyamino and/or Polyammonium-Polysiloxane-Copolymer Compounds MOMENTIVE PERFORMANCE MATERIALS GMBH (DE) 2011-02-17 US disclosed
US-7863397-B2 Reactive amino-and/or ammonium polysiloxane compounds MOMENTIVE PERFORMANCE MATERIALS GMBH (DE) 2011-01-04 US disclosed
US-7563857-B2 Linear polyamino and/or polyammonium polysiloxane copolymers I MOMENTIVE PERFORMANCE MATERIALS GMBH (DE) 2009-07-21 US disclosed
US-20080305065-A1 Novel polysiloxanes having quaternary ammonium groups, a process for the preparation thereof and the use thereof in cleaning and care formulations GOLDSCHMIDT GMBH (DE) 2008-12-11 US disclosed
US-7390479-B2 Branched polyorganosiloxane polymers GE BAYER SILICONES GMBH & CO. KG (DE) 2008-06-24 US disclosed
US-20080027202-A1 Novel polysiloxanes with quaternary ammonium groups, preparation thereof and use thereof as textile softeners GOLDSCHMIDT GMBH (DE) 2008-01-31 US disclosed
US-7217777-B2 Polymmonium-polysiloxane compounds, methods for the production and use thereof GE BAYER SILICONES GMBH & CO. KG (DE) 2007-05-15 US disclosed
US-20070106045-A1 reaction product of an isocyanate dimer containing uretidine-2,4-dione group, with an epoxy-functional silane and a diamine to form polysiloxane-urea or urethane copolymer with quaternary amine groups and uretdione in the backbone; wash resistant fabric softeners MOMENTIVE PERFORMANCE MATERIALS INC. 2007-05-10 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 (3 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-20110045186-A1 Polyhedral Oligomeric Silsesquioxane Image Conditioning Coating FLNA, VCL, ILK CA1 1762/4885CA2 4010/4885CA4 3657/4885
US-20110037012-A1 Use Of Polyamino and/or Polyammonium-Polysiloxane-Copolymer Compounds PUF60, PARG, PFAS CA1 711/4885CA2 2583/4885CA4 578/4885
US-20080305065-A1 Novel polysiloxanes having quaternary ammonium groups, a process for the preparation thereof and the use thereof in cleaning and care formulations SIN3A, POLD3, SUMO3 CA1 3117/4885CA2 2656/4885CA4 2506/4885

“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.