SCHEMBL16079679

SCHEMBL16079679

Cc1cccc(C2NC(C(=O)O)CS2)c1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.69
MAPT P10636 6/20 0.69
S1PR3 Q99500 2/20 0.61
ALDH1A1 P00352 10/20 0.60
HSD17B10 Q99714 1/20 0.58
POLB P06746 2/20 0.56
PKM P14618 1/20 0.53
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
RECQL P46063 1/20 0.51
BLM P54132 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
GFER P55789 1/20 0.51
ALOX15 P16050 2/20 0.50
PTGS1 P23219 1/20 0.46
PTGS2 P35354 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
SCHEMBL8870809 0.84 ALDH1A1 (0.62) KDM4EMAPTS1PR3ALDH1A1HSD17B10
SCHEMBL5526027 0.83 ALDH1A1 (0.76) KDM4EMAPTS1PR3ALDH1A1HSD17B10
SCHEMBL2034755 0.83 ALDH1A1 (0.76) KDM4EMAPTS1PR3ALDH1A1HSD17B10
SCHEMBL3059385 0.83 ALDH1A1 (0.76) KDM4EMAPTS1PR3ALDH1A1HSD17B10
SCHEMBL2034753 0.83 ALDH1A1 (0.76) KDM4EMAPTS1PR3ALDH1A1HSD17B10
SCHEMBL31714043 0.83 ALDH1A1 (0.76) KDM4EMAPTS1PR3ALDH1A1HSD17B10
SCHEMBL2029800 0.83 ALDH1A1 (0.76) KDM4EMAPTS1PR3ALDH1A1HSD17B10
SCHEMBL5490059 0.83 ALDH1A1 (0.76) KDM4EMAPTS1PR3ALDH1A1HSD17B10
SCHEMBL3832263 0.83 ALDH1A1 (0.60) KDM4EMAPTS1PR3ALDH1A1HSD17B10
SCHEMBL16079706 0.83 ALDH1A1 (0.60) KDM4EMAPTS1PR3ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9420790-B2 Molecules that induce disease resistance and improve growth in plants THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-08-23 US disclosed
US-20150289511-A1 MOLECULES THAT INDUCE DISEASE RESISTANCE AND IMPROVE GROWTH IN PLANTS UNIV CALIFORNIA (US) 2015-10-15 US disclosed
US-9023759-B2 Molecules that induce disease resistance and improve growth in plants THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-05-05 US disclosed
US-20140274700-A1 MOLECULES THAT INDUCE DISEASE RESISTANCE AND IMPROVE GROWTH IN PLANTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-09-18 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 (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-20150289511-A1 MOLECULES THAT INDUCE DISEASE RESISTANCE AND IMPROVE GROWTH IN PLANTS IFNG, BROX, STING1 KDM4E 3915/4885MAPT 3837/4885S1PR3 2005/4885
US-20140274700-A1 MOLECULES THAT INDUCE DISEASE RESISTANCE AND IMPROVE GROWTH IN PLANTS IFNG, BROX, STING1 KDM4E 3915/4885MAPT 3837/4885S1PR3 2005/4885

“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.