SCHEMBL1638585

SCHEMBL1638585

CCOC(=O)c1nnc(-c2cccnc2)s1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 3/20 0.56
DBF4 Q9UBU7 3/20 0.56
HSD17B10 Q99714 5/20 0.51
MAPK1 P28482 1/20 0.51
KDM4E B2RXH2 3/20 0.50
MAPT P10636 3/20 0.50
RAB9A P51151 3/20 0.50
TSHR P16473 2/20 0.50
NPC1 O15118 2/20 0.50
MEN1 O00255 1/20 0.50
POLB P06746 1/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
KMT2A Q03164 1/20 0.50
RELA Q04206 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 2/20 0.48
HTT P42858 1/20 0.48
USP2 O75604 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL18195379 0.85 ALDH1A1 (0.54) HSD17B10KDM4EMAPTRAB9ATSHR
SCHEMBL2179717 0.85 TRPM8 (0.58) CDC7DBF4HSD17B10KDM4EMAPT
SCHEMBL26524147 0.84 KMT2A (0.56) HSD17B10MAPK1KDM4EMAPTRAB9A
SCHEMBL17212202 0.83 CDC7 (0.62) CDC7DBF4HSD17B10KDM4EKMT2A
SCHEMBL1680202 0.82 RAB9A (0.59) HSD17B10KDM4EMAPTRAB9ATSHR
SCHEMBL22617521 0.80 CDC7 (0.42) CDC7DBF4HSD17B10KDM4ERAB9A
SCHEMBL1638364 0.80 CDC7 (0.73) CDC7DBF4HSD17B10MAPK1KDM4E
SCHEMBL27768803 0.80 KDM4E (0.58) HSD17B10KDM4EMAPTRAB9ATSHR
SCHEMBL1423803 0.80 HSD17B10 (0.49) CDC7DBF4HSD17B10MAPK1KDM4E
SCHEMBL255828 0.80 ALDH1A1 (0.64) HSD17B10KDM4EMAPTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2586311-B1 Heterocyclic compounds as pest controllers BAYER CROPSCIENCE AG (DE) 2016-12-14 EP disclosed
EP-2730569-B1 New amides and thioamides as pest control agents BAYER CROPSCIENCE AG (DE) 2016-11-30 EP disclosed
US-20160316755-A1 Novel Heteroaromatic Amides and Thioamides as Pesticides BAYER CROPSCIENCE AG (DE) 2016-11-03 US disclosed
US-20160316755-A1 Novel Heteroaromatic Amides and Thioamides as Pesticides BAYER CROPSCIENCE AG (DE) 2016-11-03 US disclosed
US-20160316755-A1 Novel Heteroaromatic Amides and Thioamides as Pesticides BAYER CROPSCIENCE AG (DE) 2016-11-03 US disclosed
US-9451775-B2 Heterocyclic compounds as pesticides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-09-27 US disclosed
US-9451775-B2 Heterocyclic compounds as pesticides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-09-27 US disclosed
US-9451775-B2 Heterocyclic compounds as pesticides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-09-27 US disclosed
US-9428487-B2 Heteroaromatic amides and thioamides as pesticides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-08-30 US disclosed
US-9428487-B2 Heteroaromatic amides and thioamides as pesticides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-08-30 US disclosed
EP-2583557-A1 Heterocyclic compounds as pest controllers Bayer CropScience AG (DE) 2013-04-24 EP disclosed
EP-2583556-A1 Heterocyclic compounds as pest controllers Bayer CropScience AG (DE) 2013-04-24 EP disclosed
US-20110212949-A1 Heterocyclic Compounds as Pesticides BAYER CROPSCIENCE AG 2011-09-01 US disclosed
US-20110212949-A1 Heterocyclic Compounds as Pesticides BAYER CROPSCIENCE AG 2011-09-01 US disclosed
US-20110212949-A1 Heterocyclic Compounds as Pesticides BAYER CROPSCIENCE AG 2011-09-01 US disclosed
US-20110098287-A1 Novel Heteroaromatic Amides And Thioamides As Pesticides BAYER CROPSCIENCE AG (DE) 2011-04-28 US disclosed
US-20110098287-A1 Novel Heteroaromatic Amides And Thioamides As Pesticides BAYER CROPSCIENCE AG (DE) 2011-04-28 US disclosed
US-20110098287-A1 Novel Heteroaromatic Amides And Thioamides As Pesticides BAYER CROPSCIENCE AG (DE) 2011-04-28 US disclosed
WO-2010006713-A2 HETEROCYCLIC COMPOUNDS USED AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2010-01-21 WO disclosed
WO-2009149858-A1 NOVEL HETEROAROMATIC AMIDES AND THIOAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2009-12-17 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-20160316755-A1 Novel Heteroaromatic Amides and Thioamides as Pesticides AADAC, DDT, TST CDC7 4359/4885DBF4 222/4885HSD17B10 2938/4885
US-20110212949-A1 Heterocyclic Compounds as Pesticides DDT, ACHE, PTMS CDC7 2413/4885DBF4 184/4885HSD17B10 624/4885
US-20110098287-A1 Novel Heteroaromatic Amides And Thioamides As Pesticides AADAC, DDT, TST CDC7 4359/4885DBF4 222/4885HSD17B10 2938/4885

“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.