SCHEMBL3465484

SCHEMBL3465484

CCC(Br)C(CC)(C(=O)O)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.30
PPARD Q03181 1/20 0.30
ZDHHC20 Q5W0Z9 1/20 0.30
ZDHHC2 Q9UIJ5 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
THRB P10828 1/20 0.30
KMT2A Q03164 1/20 0.30
USP2 O75604 1/20 0.30
TSHR P16473 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
SCHEMBL3061236 0.75 ALDH1A1 (0.32) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL3640223 0.73 MEN1 (0.31) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL28213928 0.73 TSHR (0.42) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL25273935 0.73 LCK (0.31) LCKPPARDZDHHC20ZDHHC2ALDH1A1
SCHEMBL10438608 0.73 CYP2C9 (0.35) LCKPPARDZDHHC20ZDHHC2ALDH1A1
SCHEMBL6321068 0.73
SCHEMBL9819871 0.72 TSHR (0.33) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL2233286 0.72 ALDH1A1 (0.33) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL21585899 0.71 DPP4 (0.30) LCKPPARDZDHHC20ZDHHC2
Ammonia Solution, Strong SCHEMBL10585171 0.71 MEN1 (0.30) MEN1ALDH1A1CYP1A2THRBKMT2A

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
US-10899863-B2 Oil soluble rheology modifying star macromolecules PILOT POLYMER TECHNOLOGIES, INC. (US) 2021-01-26 US disclosed
US-20170051094-A1 Oil Soluble Rheology Modifying Star macromolecules U.S. BANK NATIONAL ASSOCIATION, AS ADMINISTRATIVE AGENT 2017-02-23 US disclosed
US-9399694-B2 Star macromolecules for personal and home care ATRP Solutions, Inc. (US) 2016-07-26 US disclosed
US-20140024779-A1 Star Macromolecules for Personal and Home Care ATRP Solutions, Inc. (US) 2014-01-23 US disclosed
US-8569421-B2 Star macromolecules for personal and home care ATRP Solutions, Inc. (US) 2013-10-29 US disclosed
WO-2010123574-A1 STAR MACROMOLECULES FOR PERSONAL AND HOME CARE ATRP SOLUTIONS INC (US) 2010-10-28 WO disclosed
US-20100273949-A1 Star macromolecules for personal and home care U.S. BANK NATIONAL ASSOCIATION, AS ADMINISTRATIVE AGENT 2010-10-28 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 (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-20170051094-A1 Oil Soluble Rheology Modifying Star macromolecules STARD3, STARD7, CETP LCK 3564/4885PPARD 3403/4885ZDHHC20 3668/4885
US-10899863-B2 Oil soluble rheology modifying star macromolecules STARD3, STARD7, CETP LCK 3564/4885PPARD 3403/4885ZDHHC20 3668/4885

“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.