SCHEMBL28292173

SCHEMBL28292173

CC(C)(C)c1ccccc1C(=O)C(Br)(Br)Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.46
▸ TDP1 Q9NUW8 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ CA2 P00918 1/20 0.43
▸ ATM Q13315 1/20 0.39
▸ RBP4 P02753 2/20 0.38
▸ GABRA1 P14867 1/20 0.38
▸ GABRB2 P47870 1/20 0.38
▸ LMNA P02545 2/20 0.37
▸ GAA P10253 2/20 0.37
▸ ALOX15 P16050 2/20 0.37
▸ POLB P06746 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ GLRA3 O75311 1/20 0.36
▸ GLRB P48167 1/20 0.36
▸ ELANE P08246 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ PTGS1 P23219 1/20 0.36
▸ PTGS2 P35354 1/20 0.36

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
SCHEMBL11930057 0.87 ALDH1A1 (0.46) ALDH1A1TDP1TSHRCA2ATM
SCHEMBL30663932 0.84 ALDH1A1 (0.48) ALDH1A1TDP1TSHRCA2ATM
SCHEMBL9748409 0.83 CES1 (0.47) ALDH1A1TDP1TSHRCA2LMNA
SCHEMBL5325990 0.83 ALDH1A1 (0.43) ALDH1A1TDP1TSHRCA2ATM
SCHEMBL6737753 0.83 ALDH1A1 (0.46) ALDH1A1TDP1TSHRCA2ATM
SCHEMBL1148444 0.82 ALDH1A1 (0.50) ALDH1A1TDP1TSHRCA2ATM
SCHEMBL39249 0.80 ALDH1A1 (0.56) ALDH1A1TDP1TSHRCA2LMNA
SCHEMBL31028133 0.80 ALDH1A1 (0.56) ALDH1A1TDP1TSHRCA2LMNA
SCHEMBL7537141 0.80 ALDH1A1 (0.48) ALDH1A1TDP1TSHRCA2ATM
SCHEMBL360806 0.80 ALDH1A1 (0.48) ALDH1A1TDP1TSHRCA2ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106062630-B Photopolymerizable compositions for electroless plating processes 伊斯曼柯达公司 2019-11-05 — — CN disclosed
CN-110018591-A Layered structure and electronic device including it 三星电子株式会社 2019-07-16 — — CN disclosed
CN-109749733-A Quantum dot composition, quanta polymer compound and layered structure and electronic device including it 三星电子株式会社 2019-05-14 — — CN disclosed
CN-109652076-A Composition, quanta polymer compound and layer structure and electronic device including it 三星电子株式会社 2019-04-19 — — CN disclosed
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