SCHEMBL2566044

SCHEMBL2566044

CCCCCCc1ccsc1[Sn](CCCC)(CCCC)CCCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.38
TP53 P04637 3/20 0.37
CYP3A4 P08684 3/20 0.37
TYR P14679 2/20 0.37
ALOX15 P16050 2/20 0.37
TSHR P16473 2/20 0.37
MEN1 O00255 1/20 0.37
ALOX5 P09917 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HSP90AA1 P07900 1/20 0.36
G6PD P11413 1/20 0.36
HPGD P15428 1/20 0.36
CYSLTR2 Q9NS75 2/20 0.35
CYSLTR1 Q9Y271 2/20 0.35

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
SCHEMBL320882 1.00 LIPG (0.38) LIPGTP53CYP3A4TYRALOX15
SCHEMBL1685272 1.00 LIPG (0.38) LIPGTP53CYP3A4TYRALOX15
SCHEMBL2013114 0.83 LIPG (0.40) LIPGTP53CYP3A4TYRALOX15
SCHEMBL15260906 0.83 LIPG (0.40) LIPGTP53CYP3A4TYRALOX15
SCHEMBL15260959 0.83 LIPG (0.40) LIPGTP53CYP3A4TYRALOX15
SCHEMBL15168859 0.75
SCHEMBL26106213 0.75 KAT2B (0.32) KAT2B
SCHEMBL5772420 0.75 ALDH1A1 (0.34) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL9242673 0.74 LIPG (0.44) LIPGTP53CYP3A4TYRALOX15
SCHEMBL722288 0.74 LIPG (0.44) LIPGTP53CYP3A4TYRALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3243818-B1 POLYMERS OF BENZODITHIOPHENE AND THEIR USE AS ORGANIC SEMICONDUCTORS RAYNERGY TEK INC (TW) 2021-02-17 EP disclosed
US-10158079-B2 Polymers of benzodithiophene and their use as organic semiconductors MERCK PATENT GMBH (DE) 2018-12-18 US disclosed
EP-3243818-A1 POLYMERS OF BENZODITHIOPHENE AND THEIR USE AS ORGANIC SEMICONDUCTORS Merck Patent GmbH (DE) 2017-11-15 EP disclosed
EP-2560965-B1 POLYMERS OF BENZODITHIOPHENE AND THEIR USE AS ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2017-06-14 EP disclosed
US-20150207076-A1 POLYMERS OF BENZODITHIOPHENE AND THEIR USE AS ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2015-07-23 US disclosed
US-8853349-B2 Disordered organic electronic materials based on non-benzenoid 1,6-methano[10]annulene rings NATIONAL SCIENCE FOUNDATION 2014-10-07 US disclosed
US-20140166987-A1 Disordered Organic Electronic Materials Based on Non-Benzenoid 1,6-Methano[10]Annulene Rings THE JOHNS HOPKINS UNIVERSITY (US) 2014-06-19 US disclosed
EP-2560965-A1 POLYMERS OF BENZODITHIOPHENE AND THEIR USE AS ORGANIC SEMICONDUCTORS Merck Patent GmbH (DE) 2013-02-27 EP disclosed
US-20130043434-A1 POLYMERS OF BENZODITHIOPHENE AND THEIR USE AS ORGANIC SEMICONDUCTORS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-02-21 US disclosed
WO-2011131280-A1 POLYMERS OF BENZODITHIOPHENE AND THEIR USE AS ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2011-10-27 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 (3 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-20150207076-A1 POLYMERS OF BENZODITHIOPHENE AND THEIR USE AS ORGANIC SEMICONDUCTORS TST, TPST2, PPOX LIPG 4283/4885TP53 3565/4885CYP3A4 538/4885
US-20130043434-A1 POLYMERS OF BENZODITHIOPHENE AND THEIR USE AS ORGANIC SEMICONDUCTORS TST, TPST2, PPOX LIPG 4283/4885TP53 3565/4885CYP3A4 538/4885
US-10158079-B2 Polymers of benzodithiophene and their use as organic semiconductors TST, TPST2, PPOX LIPG 4283/4885TP53 3565/4885CYP3A4 538/4885

“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.