SCHEMBL2208624

SCHEMBL2208624

[c]1cc(Cc2ccccn2)ccn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
HRH3 Q9Y5N1 2/20 0.44
HRH4 Q9H3N8 1/20 0.44
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
LIN28A Q9H9Z2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
HRH1 P35367 1/20 0.40
TSHR P16473 1/20 0.40
LMNA P02545 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ALOX15 P16050 1/20 0.40
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 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
SCHEMBL7015159 0.77 CALM1 (0.50) L3MBTL1HRH3TSHRLMNATAAR1
SCHEMBL1450103 0.75 L3MBTL1 (0.50) L3MBTL1HRH3HRH4MAPTSMN1; SMN2
SCHEMBL2750124 0.75 L3MBTL1 (0.63) L3MBTL1HRH3HRH4MAPTSMN1; SMN2
SCHEMBL29373231 0.74 L3MBTL1 (0.68) L3MBTL1HRH3HRH4MAPTSMN1; SMN2
SCHEMBL64435 0.74 L3MBTL1 (0.68) L3MBTL1HRH3HRH4MAPTSMN1; SMN2
SCHEMBL41191 0.73 L3MBTL1 (0.59) L3MBTL1HRH3HRH4MAPTSMN1; SMN2
SCHEMBL29830938 0.73 L3MBTL1 (0.59) L3MBTL1HRH3HRH4MAPTSMN1; SMN2
SCHEMBL31276017 0.72 L3MBTL1 (0.66) L3MBTL1HRH3HRH4HRH1LMNA
Bromide SCHEMBL10759788 0.72 L3MBTL1 (0.66) L3MBTL1HRH3HRH4MAPTSMN1; SMN2
SCHEMBL31236458 0.72 L3MBTL1 (0.66) L3MBTL1HRH3HRH4MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220373541-A1 Tri-functional Crosslinking Reagents ETH ZURICH (CH) 2022-11-24 US disclosed
US-11385225-B2 Tri-functional crosslinking reagents ETH ZURICH (CH) 2022-07-12 US disclosed
EP-3374348-B1 TRI-FUNCTIONAL CROSSLINKING REAGENTS ETH ZUERICH (CH) 2021-11-24 EP disclosed
US-10550093-B2 Third generation taxoids and methods of using same THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2020-02-04 US disclosed
US-20180328922-A1 TRI-FUNCTIONAL CROSSLINKING REAGENTS ETH ZURICH (CH) 2018-11-15 US disclosed
EP-3374348-A1 TRI-FUNCTIONAL CROSSLINKING REAGENTS ETH Zurich (CH) 2018-09-19 EP disclosed
US-20180194744-A1 Third Generation Taxoids and Methods of Using Same THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK 2018-07-12 US disclosed
EP-3316880-A1 THIRD GENERATION TAXOIDS AND METHODS OF USING SAME The Research Foundation for The State University of New York (US) 2018-05-09 EP disclosed
US-9766235-B2 Trifunctional crosslinking reagents ETH ZURICH (CH) 2017-09-19 US disclosed
WO-2017081069-A1 TRI-FUNCTIONAL CROSSLINKING REAGENTS ETH ZURICH (CH) 2017-05-18 WO disclosed
WO-2017004478-A1 THIRD GENERATION TAXOIDS AND METHODS OF USING SAME THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2017-01-05 WO disclosed
EP-2670755-B1 TRIFUNCTIONAL CROSSLINKING REAGENTS ETH ZUERICH (CH) 2016-10-12 EP disclosed
EP-2942351-B1 TRIFUNCTIONAL CROSSLINKING REAGENTS ETH ZUERICH (CH) 2016-10-12 EP disclosed
EP-2942351-A1 TRIFUNCTIONAL CROSSLINKING REAGENTS ETH Zurich (CH) 2015-11-11 EP disclosed
US-20140011212-A1 TRIFUNCTIONAL CROSSLINKING REAGENTS ETH ZURICH (CH) 2014-01-09 US disclosed
US-7981926-B2 Fluorotaxoids RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2011-07-19 US disclosed
US-20090118355-A1 Fluorotaxoids RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2009-05-07 US disclosed
WO-2008021242-A2 FLUOROTAXOID-FATTY ACID CONJUGATES AND PHARMACEUTICAL COMPOSITIONS THEREOF THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2008-02-21 WO disclosed
WO-2007021957-A2 FLUOROTAXOIDS RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2007-02-22 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 (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-20090118355-A1 Fluorotaxoids FAU, ARF5, ARFGEF1 L3MBTL1 1807/4885HRH3 4065/4885HRH4 3265/4885
US-11385225-B2 Tri-functional crosslinking reagents ADGRF1, FCGR3B, FCGR2A L3MBTL1 4372/4885HRH3 699/4885HRH4 475/4885
US-20180194744-A1 Third Generation Taxoids and Methods of Using Same CBR3, TUBB3, CBX3 L3MBTL1 3132/4885HRH3 1273/4885HRH4 1057/4885
US-20220373541-A1 Tri-functional Crosslinking Reagents ADGRF1, SIGLEC7, ADGRE5 L3MBTL1 4611/4885HRH3 1080/4885HRH4 1086/4885
US-20180328922-A1 TRI-FUNCTIONAL CROSSLINKING REAGENTS ADGRF1, FCGR3B, FCGR2A L3MBTL1 4372/4885HRH3 699/4885HRH4 475/4885
US-10550093-B2 Third generation taxoids and methods of using same CBR3, TUBB3, CBX3 L3MBTL1 3132/4885HRH3 1273/4885HRH4 1057/4885

“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.