SCHEMBL1784622

SCHEMBL1784622

CCCCC(C)(C)CCC=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
ALDH1A1 P00352 3/20 0.43
FAAH O00519 2/20 0.43
TRPV1 Q8NER1 2/20 0.43
ADH1B P00325 2/20 0.36
ADH1C P00326 2/20 0.36
ADH1A P07327 2/20 0.36
ADH7 P40394 2/20 0.36
HIF1A Q16665 1/20 0.35
EPHX1 P07099 1/20 0.34
ADH4 P08319 1/20 0.34
FDPS P14324 1/20 0.31
MAPK1 P28482 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL1783265 0.93 TSHR (0.52) TSHRALDH1A1FAAHTRPV1ADH1B
SCHEMBL1783206 0.91 TSHR (0.59) TSHRALDH1A1FAAHTRPV1ADH1B
SCHEMBL1786827 0.85 ALDH1A1 (0.48) TSHRALDH1A1FAAHTRPV1ADH1B
SCHEMBL16940325 0.82 TSHR (0.70) TSHRALDH1A1FAAHTRPV1ADH1B
SCHEMBL27377249 0.81 TSHR (0.48) TSHRALDH1A1FAAHTRPV1HIF1A
SCHEMBL1784663 0.81 TSHR (0.52) TSHRALDH1A1FAAHTRPV1ADH1B
SCHEMBL1787521 0.79 TSHR (0.52) TSHRALDH1A1FAAHTRPV1ADH1B
SCHEMBL8897968 0.79 TSHR (0.43) TSHRALDH1A1FDPSTDP1
SCHEMBL1410490 0.78 TSHR (0.42) TSHRALDH1A1FAAHTRPV1ADH1B
SCHEMBL1782658 0.77

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
CN-115052932-A Composition, method for preparing copolymer and end use of copolymer 美国陶氏有机硅公司 2022-09-13 CN disclosed
CN-113348199-A Branched organosilicon compounds, methods of making branched organosilicon compounds, and copolymers formed therewith 美国陶氏有机硅公司 2021-09-03 CN disclosed
CN-113348174-A Branched organosilicon compounds, methods of making the branched organosilicon compounds, and related compositions 美国陶氏有机硅公司 2021-09-03 CN disclosed
CN-113330055-A Acrylate-functional branched organosilicon compounds, methods of making, and copolymers formed therewith 美国陶氏有机硅公司 2021-08-31 CN disclosed
CN-113330054-A Branched organosilicon compounds, methods of making, and copolymers formed therewith 美国陶氏有机硅公司 2021-08-31 CN disclosed
CN-113195596-A Branched organosilicon compounds, method for producing branched organosilicon compounds, and compositions containing branched organosilicon compounds 美国陶氏有机硅公司 2021-07-30 CN disclosed
CN-113166423-A Branched organosilicon compounds, method for producing branched organosilicon compounds, and compositions containing branched organosilicon compounds 美国陶氏有机硅公司 2021-07-23 CN disclosed
CN-108697592-B Silicone composition 美国陶氏有机硅公司 2021-04-27 CN disclosed
CN-108778239-B Composition and method of preparation 美国陶氏有机硅公司 2021-04-13 CN disclosed
US-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-05-19 US disclosed
WO-2009123355-A2 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-08 WO disclosed
US-7186782-B2 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2007-03-06 US disclosed
US-20060041079-A1 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION 2006-02-23 US disclosed
US-6881797-B2 Process for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2005-04-19 US disclosed
US-20040082727-A1 Process for hydrogenation of conjugated diene polymer TSRC CORPORATION (CN) 2004-04-29 US disclosed
US-5998635-A CATALYTIC CYCLIZATION AN ALDEHYDE WITH A KETENE TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-12-07 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-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TRPA1, HRH1, HRH2 TSHR 2479/4885ALDH1A1 520/4885FAAH 94/4885

“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.