SCHEMBL14093763

SCHEMBL14093763

Nc1ccc(S(=O)(=O)O)c(Nc2nc(N)nc(Nc3cc(S(=O)(=O)O)ccc3S(=O)(=O)O)n2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NT5E P21589 3/20 0.43
RAPGEF4 Q8WZA2 1/20 0.43
ALDH1A1 P00352 6/20 0.41
CASP6 P55212 4/20 0.41
TDP1 Q9NUW8 3/20 0.41
NSD2 O96028 2/20 0.41
KDM4E B2RXH2 2/20 0.41
POLB P06746 2/20 0.41
GAA P10253 2/20 0.41
MAPT P10636 2/20 0.41
RECQL P46063 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
APEX1 P27695 2/20 0.41
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
TSHR P16473 2/20 0.40

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
SCHEMBL14018102 0.92 CA1 (0.48) NT5ERAPGEF4ALDH1A1CASP6TDP1
SCHEMBL16063643 0.88 CA1 (0.45) ALDH1A1CASP6KDM4EMAPTAPEX1
SCHEMBL15987092 0.88 CA9 (0.52) RAPGEF4APEX1CA12CA1CA2
SCHEMBL14093770 0.88 CHAT (0.45) RAPGEF4ALDH1A1CASP6TDP1NSD2
SCHEMBL14076668 0.87 NT5E (0.34) NT5ERAPGEF4ALDH1A1CASP6TDP1
SCHEMBL14817394 0.87 CHAT (0.45) NT5ERAPGEF4ALDH1A1CASP6TDP1
SCHEMBL15806611 0.86 CA1 (0.40) NT5ERAPGEF4ALDH1A1CASP6TDP1
SCHEMBL13891663 0.86 CA9 (0.42) NT5ERAPGEF4ALDH1A1CASP6APEX1
SCHEMBL13475944 0.85 L3MBTL1 (0.46) ALDH1A1CASP6KDM4EL3MBTL1APEX1
SCHEMBL14462233 0.84 CA12 (0.42) RAPGEF4ALDH1A1CASP6TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7419537-B2 Having unsubstituted sulfamoyl group(s) and substituted sulfamoyl group has a substituted triazinyl group; light fastness, ozone fastness and moisture fastness NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2008-09-02 US disclosed
US-20070022903-A1 Phthalocyanine dye and use thereof for ink-jet printing NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2007-02-01 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 (1 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-20070022903-A1 Phthalocyanine dye and use thereof for ink-jet printing TYR, TDO2, TH NT5E 4265/4885RAPGEF4 4519/4885ALDH1A1 2117/4885

“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.