SCHEMBL2597530

SCHEMBL2597530

OB(O)c1ccc2ccc3c(B(O)O)ccc4ccc1c2c43

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
HPGD P15428 4/20 0.39
HSD17B10 Q99714 3/20 0.39
CYP3A4 P08684 2/20 0.39
TSHR P16473 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP1A2 P05177 3/20 0.35
THRB P10828 1/20 0.35
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ERBB2 P04626 1/20 0.32
FYN P06241 1/20 0.32
MAOA P21397 1/20 0.32
ACHE P22303 1/20 0.32
AHR P35869 1/20 0.32
CYP1A1 P04798 1/20 0.30
CYP1B1 Q16678 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL29840683 0.91 ALDH1A1 (0.54) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL224652 0.91 ALDH1A1 (0.54) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL19939964 0.89 HPGD (0.37) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL19766248 0.84 HPGD (0.59) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL3864668 0.81 MGLL (0.34) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL31338575 0.81 MGLL (0.34) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL1753908 0.81 ERBB2 (0.34) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL19562333 0.81
SCHEMBL1816278 0.81 CYP1A2 (0.65) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL31150378 0.80 CYP1A2 (0.34) ALDH1A1HPGDHSD17B10CYP3A4TSHR

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116285373-B Modified silicone rubber containing polyborosiloxane and preparation method thereof 成都魔极科技有限公司 2024-08-06 CN claimed
CN-116284797-B Rubber material containing polyborosiloxane and preparation method thereof 成都魔极科技有限公司 2024-05-28 CN claimed
CN-116285372-B Polyborosiloxane modified plastic and preparation method thereof 成都魔极科技有限公司 2024-05-28 CN claimed
CN-117534811-A Polyurea material based on boron-linked crosslinking and preparation method thereof 四川大学 2024-02-09 CN claimed
CN-117467108-A High-impact polyurea material with boron-containing structure chain extension and preparation method thereof 四川大学 2024-01-30 CN claimed
CN-116284797-A Rubber material containing polyborosiloxane and preparation method thereof 成都魔极科技有限公司 2023-06-23 CN claimed
CN-116285373-A Modified silicone rubber containing polyborosiloxane and preparation method thereof 成都魔极科技有限公司 2023-06-23 CN claimed
CN-115216013-B Polyborosiloxane rubber material and preparation method thereof 四川大学 2023-05-12 CN claimed
CN-115216013-A Poly-linked borosilicate siloxane rubber material and preparation method thereof 四川大学 2022-10-21 CN claimed
CN-116285373-B Modified silicone rubber containing polyborosiloxane and preparation method thereof 成都魔极科技有限公司 2024-08-06 CN disclosed
CN-116284797-B Rubber material containing polyborosiloxane and preparation method thereof 成都魔极科技有限公司 2024-05-28 CN disclosed
CN-116285372-B Polyborosiloxane modified plastic and preparation method thereof 成都魔极科技有限公司 2024-05-28 CN disclosed
CN-116289225-B Fiber modified based on polyborosiloxane and preparation method thereof 四川大学 2024-04-02 CN disclosed
CN-117534811-A Polyurea material based on boron-linked crosslinking and preparation method thereof 四川大学 2024-02-09 CN disclosed
EP-1957606-B1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINIESCENT DEVICES MERCK PATENT GMBH (DE) 2017-11-08 EP disclosed
US-9017825-B2 Anthracene derivatives and their use in organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-04-28 US disclosed
US-9017825-B2 Anthracene derivatives and their use in organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-04-28 US disclosed
WO-2011145876-A2 NOVEL HYBRID ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2011-11-24 WO disclosed
US-20080303423-A1 Novel Materials For Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-12-11 US disclosed
US-20080303423-A1 Novel Materials For Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-12-11 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 (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-20080303423-A1 Novel Materials For Organic Electroluminescent Devices ANXA2, ANXA7, ANXA1 ALDH1A1 576/4885HPGD 1000/4885HSD17B10 1376/4885

“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.