SCHEMBL4929465

SCHEMBL4929465

C(=NNc1ccc2ccccc2n1)c1ccc2ccccc2n1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.73
NPC1 O15118 10/20 0.64
RAB9A P51151 10/20 0.64
SMN1; SMN2 Q16637 9/20 0.64
MAPT P10636 9/20 0.64
KDM4E B2RXH2 9/20 0.64
KMT2A Q03164 8/20 0.64
HTT P42858 6/20 0.64
MEN1 O00255 6/20 0.64
TP53 P04637 2/20 0.64
NFKB1 P19838 1/20 0.64
NFKB2 Q00653 1/20 0.64
RELA Q04206 1/20 0.64
ALDH1A1 P00352 6/20 0.59
GAA P10253 4/20 0.59
MAPK1 P28482 3/20 0.59
LMNA P02545 3/20 0.59
POLB P06746 2/20 0.59
GFER P55789 1/20 0.59
XBP1 P17861 1/20 0.59

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
SCHEMBL2682159 0.85 PAX8 (0.67) PAX8NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL29692738 0.84 PAX8 (1.00) PAX8NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL1164645 0.84 PAX8 (1.00) PAX8NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4927052 0.84 PAX8 (0.70) PAX8NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL1164644 0.84 PAX8 (1.00) PAX8NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL17190844 0.83 KMT2A (0.78) PAX8NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL3071331 0.83 RAB9A (0.57) PAX8NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL29033679 0.83 KMT2A (0.78) PAX8NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL1547192 0.83 PAX8 (0.67) PAX8NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL12706326 0.83 PAX8 (0.67) PAX8NPC1RAB9ASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140171635-A1 NOVEL HYDRAZONE-BASED AND OXIME-BASED FLUORESCENT AND CHROMOPHORIC/PRO-FLUORESCENT AND PRO-CHROMOPHORIC REAGENTS AND LINKERS SOLULINK BIOSCIENCES, INC. (US) 2014-06-19 US disclosed
US-8541555-B2 Hydrazone-based and oxime-based fluorescent and chromophoric/pro-fluorescent and pro-chromophoric reagents and linkers SOLULINK BIOSCIENCES, INC. (US) 2013-09-24 US disclosed
US-20080221343-A1 Labeled biomolecules of chromophore or the fluorophore incorporated into the linker between a reactive linking moiety and a biotin molecule; proteins, nucleic acids AUDAX PRIVATE DEBT LLC, AS AGENT 2008-09-11 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-20080221343-A1 Labeled biomolecules of chromophore or the fluorophore incorporated into the linker between a reactive linking moiety and a biotin molecule; proteins, nucleic acids RRP12, MRPS22, HBG2 PAX8 2424/4885NPC1 4218/4885RAB9A 3484/4885

“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.