SCHEMBL5353222

SCHEMBL5353222

BrCc1ccc2c(Br)c3cc(CBr)ccc3c(Br)c2c1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
TRPA1 O75762 1/20 0.36
TSHR P16473 1/20 0.36
KDM4E B2RXH2 1/20 0.31
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 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
SCHEMBL8372675 0.75 ALDH1A1 (0.48) ALDH1A1TRPA1TSHRKDM4ECES2
SCHEMBL10055238 0.72 ALDH1A1 (0.38) ALDH1A1TRPA1TSHRCES2CES1
SCHEMBL8376185 0.70 TDP1 (0.45) ALDH1A1TSHRKDM4ECYP4F2CYP4A11
SCHEMBL22635008 0.70 CYP2A6 (0.38) ALDH1A1TRPA1TSHRKDM4E
SCHEMBL2692611 0.69 NCEH1 (0.37)
SCHEMBL3357562 0.69 TRPA1 (0.39) ALDH1A1TRPA1TSHRKDM4ECES2
SCHEMBL30516101 0.69 TRPA1 (0.39) ALDH1A1TRPA1TSHRKDM4ECES2
SCHEMBL5353293 0.69 MDM4 (0.36) ALDH1A1TRPA1TSHRKDM4E
SCHEMBL10759453 0.69 KDM4E (0.46) KDM4E
SCHEMBL5892854 0.68 TRPA1 (0.35) ALDH1A1TRPA1TSHRCES2CES1

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-7196225-B2 Bis(aminostyryl) anthracene compound, synthesis intermediate thereof, and process for production thereof SONY CORPORATION (JP) 2007-03-27 US disclosed
US-7196225-B2 Bis(aminostyryl) anthracene compound, synthesis intermediate thereof, and process for production thereof SONY CORPORATION (JP) 2007-03-27 US disclosed
US-7196225-B2 Bis(aminostyryl) anthracene compound, synthesis intermediate thereof, and process for production thereof SONY CORPORATION (JP) 2007-03-27 US disclosed
EP-1090911-B1 Bis(aminostyryl) anthracene compound, synthesis intermediate thereof, and process for production thereof SONY CORP (JP) 2006-08-30 EP disclosed
US-20060178522-A1 BIS(AMINOSTYRYL) ANTHRACENE COMPOUND, SYNTHESIS INTERMEDIATE THEREOF, AND PROCESS FOR PRODUCTION THEREOF JOLED INC. (JP) 2006-08-10 US disclosed
US-7049470-B1 Bis (aminostyryl) anthracene compound, synthesis is intermediate thereof, and process for production thereof SONY CORPORATION (JP) 2006-05-23 US disclosed
EP-1090911-A2 Bis(aminostyryl) anthracene compound, synthesis intermediate thereof, and process for production thereof SONY CORPORATION (JP) 2001-04-11 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-20060178522-A1 BIS(AMINOSTYRYL) ANTHRACENE COMPOUND, SYNTHESIS INTERMEDIATE THEREOF, AND PROCESS FOR PRODUCTION THEREOF AASDHPPT, DDC, AADAT ALDH1A1 782/4885TRPA1 812/4885TSHR 4248/4885

“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.