SCHEMBL4154910

SCHEMBL4154910

CCOC(=O)c1cnncc1N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
HSD17B10 Q99714 1/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
TSHR P16473 3/20 0.50
HSP90AA1 P07900 1/20 0.49
KDM4E B2RXH2 3/20 0.48
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
HPGD P15428 1/20 0.47
GAA P10253 1/20 0.46
MAPK1 P28482 1/20 0.46
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAOA P21397 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
CSNK1D P48730 1/20 0.46

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
SCHEMBL17146906 0.86 TSHR (0.59) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL29421500 0.81 TSHR (0.53) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL352645 0.81 TSHR (0.53) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL29433274 0.79 KDM4E (0.59) ALDH1A1HSD17B10TSHRKDM4EHPGD
SCHEMBL13163932 0.79 KDM4E (0.59) ALDH1A1HSD17B10TSHRKDM4EHPGD
SCHEMBL1888320 0.77 ALDH1A1 (0.60) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL1841640 0.77 ALDH1A1 (0.68) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL29790003 0.77 ALDH1A1 (0.68) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL7471868 0.76 ALDH1A1 (0.63) ALDH1A1HSD17B10MEN1KMT2ATSHR
Hydrochloric Acid SCHEMBL5779631 0.76 ALDH1A1 (0.66) ALDH1A1HSD17B10MEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069333-A1 FUNGICIDES SYNGENTA CROP PROTECTION, INC. (US) 2009-03-12 US disclosed
US-7410967-B2 Pyridodiazines as plant fungicides SYNGENTA CROP PROTECTION, INC. (US) 2008-08-12 US disclosed
EP-1575948-B1 PYRIDODIAZINES AS PLANT FUNGICIDES SYNGENTA LTD (GB) 2007-02-14 EP disclosed
US-20060205717-A1 Pyridodiazines as plant fungicides SYNGENTA CROP PROTECTION, INC. 2006-09-14 US disclosed
EP-1575948-A1 PYRIDODIAZINES AS PLANT FUNGICIDES Syngenta Limited (GB) 2005-09-21 EP disclosed
WO-2004056825-A1 PYRIDODIAZINES AS PLANT FUNGICIDES SYNGENTA LIMITED (GB) 2004-07-08 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 (2 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-20090069333-A1 FUNGICIDES CYP4Z1, CYP4X1, PRXL2A ALDH1A1 1469/4885HSD17B10 2955/4885MEN1 1969/4885
US-20060205717-A1 Pyridodiazines as plant fungicides CYP4Z1, CYP4X1, PNPO ALDH1A1 917/4885HSD17B10 2029/4885MEN1 2352/4885

“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.