SCHEMBL348429

SCHEMBL348429

c1ccc([N]c2cccc3cc4ccccc4cc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.41
ALDH1A1 P00352 11/20 0.39
KDM4E B2RXH2 4/20 0.39
GAA P10253 3/20 0.39
CYP1A2 P05177 5/20 0.38
MAOA P21397 2/20 0.38
ACHE P22303 2/20 0.38
ERBB2 P04626 1/20 0.38
FYN P06241 1/20 0.38
AHR P35869 1/20 0.38
HSD17B10 Q99714 6/20 0.37
HIF1A Q16665 2/20 0.37
CYP1B1 Q16678 1/20 0.37
HPGD P15428 7/20 0.36
KMT2A Q03164 4/20 0.36
GLA P06280 3/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
PTBP1 P26599 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
SCHEMBL2256805 0.87 SIGMAR1 (0.45) SIGMAR1ALDH1A1KDM4EGAACYP1A2
SCHEMBL5145312 0.85 NPC1 (0.41) SIGMAR1ALDH1A1KDM4EGAACYP1A2
SCHEMBL6542069 0.85 SIGMAR1 (0.44) SIGMAR1ALDH1A1KDM4EGAACYP1A2
SCHEMBL6542058 0.85 SIGMAR1 (0.44) SIGMAR1ALDH1A1KDM4EGAACYP1A2
SCHEMBL6542100 0.85 SIGMAR1 (0.44) SIGMAR1ALDH1A1KDM4EGAACYP1A2
SCHEMBL6541314 0.85 SIGMAR1 (0.44) SIGMAR1ALDH1A1KDM4EGAACYP1A2
SCHEMBL2576555 0.84 SIGMAR1 (0.40) SIGMAR1ALDH1A1KDM4EGAACYP1A2
SCHEMBL3089392 0.82 ALDH1A1 (0.46) SIGMAR1ALDH1A1KDM4EGAACYP1A2
SCHEMBL2254008 0.82 SIGMAR1 (0.49) SIGMAR1ALDH1A1KDM4EGAACYP1A2
SCHEMBL6540930 0.82 ALDH1A1 (0.48) SIGMAR1ALDH1A1KDM4EGAACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9028976-B2 Organic EL device FUTABA CORPORATION (JP) 2015-05-12 US claimed
EP-1916244-B1 THIOPHENE COMPOUND HAVING SULFONYL GROUP AND PROCESS FOR PRODUCING THE SAME NISSAN CHEMICAL IND LTD (JP) 2013-12-04 EP claimed
EP-1882694-B1 OLIGOMERS AND POLYMERS OF THIOPHENE COMPOUNDS HAVING PHOSPHORIC ESTER AND PROCESS FOR PRODUCING THE SAME NISSAN CHEMICAL IND LTD (JP) 2013-04-03 EP claimed
US-8008425-B2 Thiophene compound having sulfonyl group and process for producing the same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-08-30 US claimed
US-20090127491-A1 THIOPHENE COMPOUND HAVING SULFONYL GROUP AND PROCESS FOR PRODUCING THE SAME NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-05-21 US claimed
EP-1916244-A1 THIOPHENE COMPOUND HAVING SULFONYL GROUP AND PROCESS FOR PRODUCING THE SAME Nissan Chemical Industries, Ltd. (JP) 2008-04-30 EP claimed
WO-2020203594-A1 FLUORENE DERIVATIVE AND USE THEREOF 日産化学株式会社 2020-10-08 WO disclosed
EP-3404017-B1 FLUORINE ATOM-CONTAINING COMPOUND AND USE THEREOF NISSAN CHEMICAL IND LTD (JP) 2020-05-13 EP disclosed
US-10336686-B2 Fluorine atom-containing compound and use thereof NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2019-07-02 US disclosed
US-20190031600-A1 FLUORINE ATOM-CONTAINING COMPOUND AND USE THEREOF NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2019-01-31 US disclosed
EP-3404017-A1 FLUORINE ATOM-CONTAINING COMPOUND AND USE THEREOF Nissan Chemical Industries, Ltd. (JP) 2018-11-21 EP disclosed
EP-2448925-B1 EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORP (JP) 2017-12-06 EP disclosed
US-9028976-B2 Organic EL device FUTABA CORPORATION (JP) 2015-05-12 US disclosed
US-20040151944-A1 Anode, cathode, light emitting layers TOYO INK MFG. CO., LTD. (JP) 2004-08-05 US disclosed
US-20040043247-A1 Organic electroluminescence devices using pyrazolo [3,4B] quinoxaline derivatives INTELLECTUAL VENTURES HOLDING 57 LLC 2004-03-04 US disclosed
US-20030065171-A1 Luminescent element material, luminescent element, ethylene derivative having n-containing 7-membered ring, and benzoazepine derivative FUJI PHOTO FILM CO., LTD. 2003-04-03 US disclosed
US-6444333-B1 CHARGE TRANSFER COMPOUNDS FUJI PHOTO FILM CO., LTD. (JP) 2002-09-03 US disclosed
US-6413657-B1 FOR USE IN ELECTRICAL DEVICES AND IN ELECTROPHOTOGRAPHY PHOTORECEPTORS FUJI PHOTO FILM CO., LTD. (JP) 2002-07-02 US disclosed
EP-1079668-A2 El display apparatus TDK Corporation (JP) 2001-02-28 EP disclosed
US-5929235-A Aromatic tertiary amine compound having benzazepine structures FUJI PHOTO FILM CO., LTD. (JP) 1999-07-27 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 (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-10336686-B2 Fluorine atom-containing compound and use thereof ARF1, ARF5, ARFGAP1 SIGMAR1 1214/4885ALDH1A1 982/4885KDM4E 2973/4885
US-20190031600-A1 FLUORINE ATOM-CONTAINING COMPOUND AND USE THEREOF ARF1, ARF5, ARFGAP1 SIGMAR1 1214/4885ALDH1A1 982/4885KDM4E 2973/4885
US-20030065171-A1 Luminescent element material, luminescent element, ethylene derivative having n-containing 7-membered ring, and benzoazepine derivative EPN1, ERLIN1, NUCB2 SIGMAR1 1467/4885ALDH1A1 1168/4885KDM4E 1705/4885
US-20090127491-A1 THIOPHENE COMPOUND HAVING SULFONYL GROUP AND PROCESS FOR PRODUCING THE SAME TST, ABCG2, CBR3 SIGMAR1 41/4885ALDH1A1 1104/4885KDM4E 2440/4885

“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.