SCHEMBL4875827

SCHEMBL4875827

CCCCC(I)(CCCC)CCCC

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
LMNA P02545 1/20 0.40
THRB P10828 1/20 0.38
GGPS1 O95749 1/20 0.35
FDPS P14324 1/20 0.35
ESR1 P03372 2/20 0.32
ESR2 Q92731 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SLC22A1 O15245 2/20 0.30
SLC22A2 O15244 1/20 0.30
SMN1; SMN2 Q16637 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
Phosphine SCHEMBL2473317 0.97 TSHR (0.38) TSHRLMNATHRBGGPS1FDPS
Ammonia Solution, Strong SCHEMBL6265351 0.97 TSHR (0.38) TSHRLMNATHRBGGPS1FDPS
SCHEMBL28605752 0.94 GGPS1 (0.42) TSHRLMNATHRBGGPS1FDPS
SCHEMBL29260490 0.87 TSHR (0.35) TSHRLMNATHRBGGPS1FDPS
Phosphine SCHEMBL3859233 0.84 TSHR (0.47) TSHRTHRBGGPS1FDPS
Ammonia Solution, Strong SCHEMBL7557119 0.84 TSHR (0.47) TSHRTHRBGGPS1FDPS
Ammonia Solution, Strong SCHEMBL8956892 0.84 TSHR (0.47) TSHRTHRBGGPS1FDPS
SCHEMBL29284796 0.82 TSHR (0.32) TSHRLMNATHRBGGPS1FDPS
SCHEMBL5533667 0.79
SCHEMBL5523842 0.79 TSHR (0.40) TSHRLMNATHRBGGPS1FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111398605-B Glycosylated hemoglobin measurement composition 龟甲万株式会社 2024-04-05 CN disclosed
CN-112105677-B Resin composition, resin sheet, and laminate 琳得科株式会社 2023-03-28 CN disclosed
US-20080261923-A1 Alkene Mimics NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-10-23 US disclosed
US-20070015892-A1 Method for producing polymer, polymer, composition for forming insulating film, method for producing insulating film, and insulating film JSR CORPORATION (JP) 2007-01-18 US disclosed
EP-1705206-A1 METHOD FOR PRODUCING POLYMER, POLYMER, COMPOSITION FOR FORMING INSULATING FILM, METHOD FOR PRODUCING INSULATING FILM, AND INSULATING FILM JSR Corporation (JP) 2006-09-27 EP disclosed
WO-2006020417-A2 ALKENE MIMICS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2006-02-23 WO disclosed
EP-0710241-A1 NOVEL SILYLATED BENZYLAMINE DERIVATIVES, SALTS THEREOF, METHODS OF MANUFACTURE AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PIERRE FABRE MEDICAMENT (FR) 1996-05-08 EP disclosed
WO-1995003313-A1 NOVEL SILYLATED BENZYLAMINE DERIVATIVES, SALTS THEREOF, METHODS OF MANUFACTURE AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PIERRE FABRE MEDICAMENT (FR) 1995-02-02 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 (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-20080261923-A1 Alkene Mimics PHOSPHO1, PARN, CHAMP1 TSHR 3267/4885LMNA 1092/4885THRB 1211/4885

“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.