SCHEMBL2016030

SCHEMBL2016030

CCCC[Sn](CCC)(CCCC)CCCC

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
LMNA P02545 1/20 0.40
THRB P10828 1/20 0.38
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
SCHEMBL6473610 1.00 TSHR (0.40) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL1027840 1.00 TSHR (0.40) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL135552 0.93 TSHR (0.46) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL28438742 0.93 TSHR (0.46) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL1029400 0.90 TSHR (0.44) TSHRLMNATHRBALDH1A1SLC22A1
SCHEMBL2139803 0.89 TSHR (0.43) TSHRLMNATHRBALDH1A1TDP1
Iodide SCHEMBL6657020 0.89 TSHR (0.43) TSHRLMNATHRBALDH1A1TDP1
Hydrochloric Acid SCHEMBL336735 0.89 TSHR (0.43) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL3577655 0.89 TSHR (0.43) TSHRLMNATHRBALDH1A1TDP1
Water SCHEMBL3700992 0.89 TSHR (0.43) TSHRLMNATHRBALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118382625-A Pyridine [4,3-d ] pyrimidines as TLR7/8 agonists 上海维申医药有限公司 2024-07-23 CN disclosed
CN-110167560-B Tetracycline compounds and methods of treatment 四相制药公司 2023-08-18 CN disclosed
CN-114262301-A Small molecule antagonist targeting EP4 receptor and application thereof in osteoarthritis and cartilage defect treatment 华东师范大学 2022-04-01 CN disclosed
US-11214582-B2 4-substituted benzoxaborole compounds and uses thereof GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2022-01-04 US disclosed
EP-3560923-B1 ANTI PARASITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME BOEHRINGER INGELHEIM ANIMAL HEALTH USA INC (US) 2021-05-05 EP disclosed
US-20210053996-A1 4-Substituted Benzoxaborole Compounds and Uses Thereof GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2021-02-25 US disclosed
US-10774096-B2 4-substituted benzoxaborole compounds and uses thereof GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2020-09-15 US disclosed
EP-3256479-B1 4 -SUBSTITUTED BENZOXABOROLE COMPOUNDS AND USES THEREOF GLAXOSMITHKLINE IP NO 2 LTD (GB) 2020-07-29 EP disclosed
EP-3560923-A1 ANTI PARASITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME Boehringer Ingelheim Animal Health USA Inc. (US) 2019-10-30 EP disclosed
EP-3078664-B1 ANTIPARASITIC DIHYDROAZOLE COMPOSITIONS MERIAL INC (US) 2019-02-20 EP disclosed
US-9376434-B2 Antiparisitic dihydroazole compounds and compositions comprising same MERIAL INC. (US) 2016-06-28 US disclosed
EP-2513104-B1 ANTIPARASITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL INC (US) 2016-03-16 EP disclosed
US-20150183785-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL, INC. (US) 2015-07-02 US disclosed
US-8980893-B2 Antiparisitic dihydroazole compounds and compositions comprising same MERIAL, INC. (US) 2015-03-17 US disclosed
US-20140315794-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL LIMITED (US) 2014-10-23 US disclosed
US-8618126-B2 Antiparisitic dihydroazole compounds and compositions comprising same MERIAL LIMITED (US) 2013-12-31 US disclosed
EP-2513104-A1 ANTI PARASITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME Merial Limited (US) 2012-10-24 EP disclosed
WO-2011075591-A1 ANTI PARASITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL LIMITED (US) 2011-06-23 WO disclosed
US-20110152312-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL, INC. 2011-06-23 US disclosed
WO-2005029552-A2 SN-C STRUCTURES PREPARED BY PLASMA-ENHANCED CHEMICAL VAPOR DEPOSITION MIDWEST RESEARCH INSTITUTE (US) 2005-03-31 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 (6 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-20140315794-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME DDT, CYP1A1, CYP1A2 TSHR 3439/4885LMNA 2295/4885THRB 4428/4885
US-20110152312-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME DDT, CYP1A1, CYP1A2 TSHR 3439/4885LMNA 2295/4885THRB 4428/4885
US-20210053996-A1 4-Substituted Benzoxaborole Compounds and Uses Thereof BRI3BP, CBR3, CYCS TSHR 2375/4885LMNA 2141/4885THRB 1266/4885
US-11214582-B2 4-substituted benzoxaborole compounds and uses thereof BRI3BP, CBR3, CYCS TSHR 2375/4885LMNA 2141/4885THRB 1266/4885
US-20150183785-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME DDT, CYP1A1, CYP1A2 TSHR 3439/4885LMNA 2295/4885THRB 4428/4885
US-10774096-B2 4-substituted benzoxaborole compounds and uses thereof BRD4, BRD3, CBR3 TSHR 1859/4885LMNA 1742/4885THRB 631/4885

“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.