SCHEMBL2486863

SCHEMBL2486863

O=C(O)c1ccc2c(c1)sc1c3ccc(C(=O)O)cc3sc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
TBXAS1 P24557 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
HKDC1 Q2TB90 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
NFKB1 P19838 2/20 0.45
NFKB2 Q00653 2/20 0.45
RELA Q04206 2/20 0.45
LMNA P02545 1/20 0.45
TSHR P16473 2/20 0.44
TP53 P04637 1/20 0.44
POLB P06746 2/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43

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
SCHEMBL30414903 0.87 KDM4E (0.48) KDM4ENPC1RAB9ATBXAS1L3MBTL1
SCHEMBL204515 0.87 KDM4E (0.48) KDM4ENPC1RAB9ATBXAS1L3MBTL1
SCHEMBL12887203 0.85 LIMK1 (0.48) KDM4ELMNATSHRTP53LIMK1
SCHEMBL12887207 0.85 LIMK1 (0.48) KDM4ELMNATSHRTP53LIMK1
SCHEMBL30414825 0.83 KDM4E (0.46) KDM4ENPC1RAB9ATBXAS1L3MBTL1
SCHEMBL12887206 0.83 RARB (0.48) KDM4ENPC1RAB9ATDP1SMN1; SMN2
SCHEMBL10993529 0.82 GPR35 (0.61) KDM4ENPC1RAB9ATBXAS1L3MBTL1
SCHEMBL28456554 0.82 TTR (0.49) KDM4ENPC1RAB9ATBXAS1L3MBTL1
SCHEMBL10031355 0.82 LIMK1 (0.47) NPC1RAB9AL3MBTL1LMNAGAA
Hydrochloric Acid SCHEMBL11595018 0.79 CYP1A2 (0.50) KDM4ENPC1RAB9ATBXAS1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9029840-B2 Organic nanofiber structure based on self-assembled organogel, organic nanofiber transistor using the same, and method of manufacturing the organic nanofiber transistor SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-05-12 US disclosed
US-8440713-B2 [1]benzothieno[3,2-B][1]benzothiophene compound and method for producing the same, and organic electronic device using the same RICOH COMPANY, LTD. (JP) 2013-05-14 US disclosed
US-8440713-B2 [1]benzothieno[3,2-B][1]benzothiophene compound and method for producing the same, and organic electronic device using the same RICOH COMPANY, LTD. (JP) 2013-05-14 US disclosed
US-20130069040-A1 ORGANIC NANOFIBER STRUCTURE BASED ON SELF-ASSEMBLED ORGANOGEL, ORGANIC NANOFIBER TRANSISTOR USING THE SAME, AND METHOD OF MANUFACTURING THE ORGANIC NANOFIBER TRANSISTOR SEOUL NATIONAL UNIVERSITY R&DB FOUNDATION (KR) 2013-03-21 US disclosed
US-8362464-B2 Organic nanofiber structure based on self-assembled organogel, organic nanofiber transistor using the same, and method of manufacturing the organic nanofiber transistor SAMSUNG ELECTRONICS CO., LTD. (KR) 2013-01-29 US disclosed
EP-1847544-B1 NOVEL CONDENSED POLYCYCLIC AROMATIC COMPOUND AND USE THEREOF UNIV HIROSHIMA NAT UNIV CORP (JP) 2011-10-19 EP disclosed
US-20110040107-A1 [1]BENZOTHIENO[3,2-B][1]BENZOTHIOPHENE COMPOUND AND METHOD FOR PRODUCING THE SAME, AND ORGANIC ELECTRONIC DEVICE USING THE SAME RICOH COMPANY, LTD. (JP) 2011-02-17 US disclosed
US-20110040107-A1 [1]BENZOTHIENO[3,2-B][1]BENZOTHIOPHENE COMPOUND AND METHOD FOR PRODUCING THE SAME, AND ORGANIC ELECTRONIC DEVICE USING THE SAME RICOH COMPANY, LTD. (JP) 2011-02-17 US disclosed
US-20100006830-A1 Organic semiconductor compound based on 2,7-bis-(vinyl)[1]benzothieno[3,2-b]benzothiophene, organic semiconductor thin film and transistor using the same and methods of forming the same SAMSUNG ELECTRONICS CO., LTD. 2010-01-14 US disclosed
US-20100006824-A1 ORGANIC NANOFIBER STRUCTURE BASED ON SELF-ASSEMBLED ORGANOGEL, ORGANIC NANOFIBER TRANSISTOR USING THE SAME, AND METHOD OF MANUFACTURING THE ORGANIC NANOFIBER TRANSISTOR SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-01-14 US disclosed
WO-2009128559-A1 [1]BENZOTHIENO[3,2-B][1]BENZOTHIOPHENE COMPOUND AND METHOD FOR PRODUCING THE SAME, AND ORGANIC ELECTRONIC DEVICE USING THE SAME RICOH COMPANY, LTD. (JP) 2009-10-22 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 (4 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-20130069040-A1 ORGANIC NANOFIBER STRUCTURE BASED ON SELF-ASSEMBLED ORGANOGEL, ORGANIC NANOFIBER TRANSISTOR USING THE SAME, AND METHOD OF MANUFACTURING THE ORGANIC NANOFIBER TRANSISTOR GAP43, NOTCH4, OGA KDM4E 3687/4885NPC1 3039/4885RAB9A 2734/4885
US-20110040107-A1 [1]BENZOTHIENO[3,2-B][1]BENZOTHIOPHENE COMPOUND AND METHOD FOR PRODUCING THE SAME, AND ORGANIC ELECTRONIC DEVICE USING THE SAME KYAT1, SULT1E1, SULT1A1 KDM4E 1652/4885NPC1 2974/4885RAB9A 4386/4885
US-20100006830-A1 Organic semiconductor compound based on 2,7-bis-(vinyl)[1]benzothieno[3,2-b]benzothiophene, organic semiconductor thin film and transistor using the same and methods of forming the same BPNT1, TST, SULT1E1 KDM4E 468/4885NPC1 3953/4885RAB9A 3374/4885
US-20100006824-A1 ORGANIC NANOFIBER STRUCTURE BASED ON SELF-ASSEMBLED ORGANOGEL, ORGANIC NANOFIBER TRANSISTOR USING THE SAME, AND METHOD OF MANUFACTURING THE ORGANIC NANOFIBER TRANSISTOR GAP43, NOTCH4, OGA KDM4E 3687/4885NPC1 3039/4885RAB9A 2734/4885

“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.