SCHEMBL2327286

SCHEMBL2327286

Cc1cccc(NC(=N)OC(N)=O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.56
CYP1A2 P05177 1/20 0.54
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
RXFP1 Q9HBX9 1/20 0.51
ALDH1A1 P00352 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MAPK1 P28482 2/20 0.48
FAAH O00519 1/20 0.48
CYP3A4 P08684 1/20 0.48
NPC1 O15118 1/20 0.48
TP53 P04637 1/20 0.48
NFKB1 P19838 1/20 0.48
RAB9A P51151 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
GRIN2D O15399 1/20 0.48
GRIN3B O60391 1/20 0.48
GRIN1 Q05586 1/20 0.48
GRIN2A Q12879 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
SCHEMBL1740852 0.81 CYP1A2 (0.67) HSD17B10CYP1A2KMT2AMEN1RXFP1
SCHEMBL166848 0.78 HSD17B10 (0.69) HSD17B10CYP1A2KMT2AMEN1RXFP1
Hydrochloric Acid SCHEMBL8884354 0.76 HSD17B10 (0.67) HSD17B10CYP1A2KMT2AMEN1RXFP1
Benzene SCHEMBL15881255 0.76 HSD17B10 (0.67) HSD17B10CYP1A2KMT2AMEN1RXFP1
Nitric Acid SCHEMBL1880262 0.75 CYP1A2 (0.54) HSD17B10CYP1A2KMT2AMEN1RXFP1
SCHEMBL2492250 0.74 HSD17B10 (0.69) HSD17B10CYP1A2KMT2AMEN1RXFP1
SCHEMBL6422898 0.74 HSD17B10 (0.62) HSD17B10CYP1A2KMT2AMEN1RXFP1
SCHEMBL4416620 0.74 SMN1; SMN2 (0.77) HSD17B10KMT2AMEN1RXFP1ALDH1A1
SCHEMBL21567990 0.74 HSD17B10 (0.74) HSD17B10CYP1A2KMT2AMEN1RXFP1
SCHEMBL692386 0.74 HSD17B10 (0.74) HSD17B10CYP1A2KMT2AMEN1RXFP1

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-20160067257-A1 SCREENING METHOD AND COMPOUNDS FOR MODULATING TELOMERASE ACTIVITY THE WISTAR INSTITUTE (US) 2016-03-10 US disclosed
US-9234230-B2 Screening method and compounds for modulating telomerase activity THE WISTAR INSTITUTE (US) 2016-01-12 US disclosed
US-8518940-B2 FP-pocket-binding effectors and methods for using the same to modulate telomerase activity THE WISTAR INSTITUTE (US) 2013-08-27 US disclosed
US-20120309759-A1 Screening Method and Compounds for Modulating Telomerase Activity THE WISTAR INSTITUTE (US) 2012-12-06 US disclosed
WO-2011097600-A1 SCREENING METHOD AND COMPOUNDS FOR MODULATING TELOMERASE ACTIVITY THE WISTAR INSTITUTE (US) 2011-08-11 WO disclosed
US-20100158798-A1 FP-Pocket-Binding Effectors and Methods for Using the Same to Modulate Telomerase Activity THE WISTAR INSTITUTE 2010-06-24 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 (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-20120309759-A1 Screening Method and Compounds for Modulating Telomerase Activity TERT, TERB1, TERF2 HSD17B10 2166/4885CYP1A2 4022/4885KMT2A 2921/4885
US-20100158798-A1 FP-Pocket-Binding Effectors and Methods for Using the Same to Modulate Telomerase Activity TERF2IP, TERF2, TERT HSD17B10 3662/4885CYP1A2 4657/4885KMT2A 2483/4885
US-20160067257-A1 SCREENING METHOD AND COMPOUNDS FOR MODULATING TELOMERASE ACTIVITY TERT, TERB1, TERF2 HSD17B10 2166/4885CYP1A2 4022/4885KMT2A 2921/4885

“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.