SCHEMBL5489477

SCHEMBL5489477

CCCCCCCCC1=[C]C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
THRB P10828 1/20 0.42
SCD O00767 1/20 0.38
PTGS2 P35354 3/20 0.37
ESR1 P03372 2/20 0.37
ADRA2A P08913 2/20 0.37
ADORA3 P0DMS8 2/20 0.37
TACR2 P21452 2/20 0.37
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
KCNH2 Q12809 2/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SHBG P04278 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
HSPD1 P10809 1/20 0.37
ADRB3 P13945 1/20 0.37

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
Hexadecane SCHEMBL22136 0.65 TSHR (1.00) TSHRTHRBALDH1A1LMNAHSD17B10
Tetradecane SCHEMBL10526119 0.65 TSHR (1.00) TSHRTHRBALDH1A1LMNAHSD17B10
Decane SCHEMBL3666565 0.65 TSHR (1.00) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL23854647 0.65 TSHR (1.00) TSHRTHRBALDH1A1LMNAHSD17B10
Tetradecane SCHEMBL25387874 0.65 TSHR (1.00) TSHRTHRBALDH1A1LMNAHSD17B10
Decane SCHEMBL23499900 0.65 TSHR (1.00) TSHRTHRBALDH1A1LMNAHSD17B10
Hexadecane SCHEMBL23499901 0.65 TSHR (1.00) TSHRTHRBALDH1A1LMNAHSD17B10
Tetradecane SCHEMBL23924271 0.65 TSHR (1.00) TSHRTHRBALDH1A1LMNAHSD17B10
Decane SCHEMBL8505762 0.65 TSHR (1.00) TSHRTHRBALDH1A1LMNAHSD17B10
Undecane SCHEMBL20767628 0.65 TSHR (1.00) TSHRTHRBALDH1A1LMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105143456-A Lipid nanoparticles for transfection and related methods UNIV BRITISH COLUMBIA 2015-12-09 CN claimed
EP-1000037-A1 PYRIMIDYL OXYPHENYLACETIC ACID DERIVATIVES Bayer Aktiengesellschaft (DE) 2000-05-17 EP claimed
WO-1999005122-A1 PYRIMIDYL OXYPHENYLACETIC ACID DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1999-02-04 WO claimed
CN-105813721-B Device for dispensing particles in small volumes 不列颠哥伦比亚大学 2019-11-05 CN disclosed
CN-108291228-A C/EBP α SARNA compositions and methods of use 米纳治疗有限公司 2018-07-17 CN disclosed
CN-107533076-A Continuous stream microfluid system 不列颠哥伦比亚大学 2018-01-02 CN disclosed
CN-107207413-A Cationic lipid 卫材R&D管理有限公司 2017-09-26 CN disclosed
CN-107075515-A C/EBP alpha compositions and methods of use 米纳治疗有限公司 2017-08-18 CN disclosed
CN-105143456-A Lipid nanoparticles for transfection and related methods UNIV BRITISH COLUMBIA 2015-12-09 CN disclosed
US-20070117720-A1 Compositions with cyclopropenes AGROFRESH, INC. 2007-05-24 US disclosed
EP-1787513-A2 Compositions with cyclopropenes Rohm and Haas Company (US) 2007-05-23 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 (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-20070117720-A1 Compositions with cyclopropenes MYB, OSBP, FAR1 TSHR 2195/4885THRB 1533/4885SCD 99/4885

“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.