SCHEMBL7107112

SCHEMBL7107112

CCCC=C(C(=O)CBr)C(=O)OCCC

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.34
ALDH1A1 P00352 2/20 0.33
FAAH O00519 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GLO1 Q04760 1/20 0.32
TRPA1 O75762 1/20 0.31
EP300 Q09472 1/20 0.31
GAA P10253 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
SCHEMBL7107108 1.00 HCAR2 (0.34) HCAR2ALDH1A1FAAHNPSR1GLO1
SCHEMBL7107496 0.90 ATM (0.42) HCAR2ALDH1A1FAAHNPSR1EP300
SCHEMBL7105156 0.90 EP300 (0.40) HCAR2ALDH1A1FAAHEP300
SCHEMBL7107499 0.90 ATM (0.42) HCAR2ALDH1A1FAAHNPSR1EP300
SCHEMBL7105155 0.90 EP300 (0.40) HCAR2ALDH1A1FAAHEP300
SCHEMBL7104844 0.89 FAAH (0.44) HCAR2ALDH1A1FAAHNPSR1EP300
SCHEMBL7101399 0.89 EP300 (0.46) FAAHTRPA1EP300
SCHEMBL7101402 0.89 EP300 (0.46) FAAHTRPA1EP300
SCHEMBL7104841 0.89 FAAH (0.44) HCAR2ALDH1A1FAAHNPSR1EP300
SCHEMBL7104683 0.88 NPSR1 (0.44) ALDH1A1FAAHNPSR1GLO1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1000939-B1 Producing z-isomer of hydrogen bromide salt of 2-aminothiazole derivative SUMITOMO CHEMICAL CO (JP) 2003-09-17 EP disclosed
US-6403572-B1 REACTING ACID SALT OF A 2-AMINOTHIAZOLE COMPOUND WITH INORGANIC ACID SUMITOMO CHEMICAL CO., LTD. (JP) 2002-06-11 US disclosed
US-20020058818-A1 Producing Z-isomer of hydrogen bromide salt of 2-aminothiazole derivative SUMITOMO CHEMICAL CO., LTD. 2002-05-16 US disclosed
US-6340763-B1 SALT FORMATION AND CRYSTALLIZATION, REACTION OF HALOGENATED COMPOUND AND THIOUREA COMPOUND SUMITOMO CHEMICAL CO., LTD. (JP) 2002-01-22 US disclosed
EP-1000939-A1 Producing z-isomer of hydrogen bromide salt of 2-aminothiazole derivative SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-05-17 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-20020058818-A1 Producing Z-isomer of hydrogen bromide salt of 2-aminothiazole derivative ZYX, H1-0, HAO2 HCAR2 1457/4885ALDH1A1 2333/4885FAAH 4261/4885

“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.