SCHEMBL19975859

SCHEMBL19975859

CCCCCCn1cc[n+](CCCN)c1/N=N/c1cnn(CCCCCC)c1N

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.35
CA2 P00918 5/20 0.35
EEF2K O00418 2/20 0.33
EEF2 P13639 2/20 0.33
MEN1 O00255 1/20 0.33
PLK4 O00444 1/20 0.33
JAK2 O60674 1/20 0.33
EGFR P00533 1/20 0.33
TYK2 P29597 1/20 0.33
FLT3 P36888 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
ITK Q08881 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
TLR8 Q9NR97 2/20 0.32

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
SCHEMBL19975860 0.99 CA1 (0.34) CA1CA2EEF2KEEF2MEN1
SCHEMBL19975872 0.99 CA1 (0.34) CA1CA2EEF2KEEF2MEN1
Hydrochloric Acid SCHEMBL19970395 0.97 CA1 (0.35) CA1CA2EEF2KEEF2MEN1
Hydrochloric Acid SCHEMBL19970407 0.97 CA1 (0.35) CA1CA2EEF2KEEF2MEN1
Hydrochloric Acid SCHEMBL19970403 0.97 CA1 (0.35) CA1CA2EEF2KEEF2MEN1
Hydrochloric Acid SCHEMBL19970399 0.97 CA1 (0.35) CA1CA2EEF2KEEF2MEN1
SCHEMBL19979261 0.97 CA1 (0.37) CA1CA2EEF2KEEF2MEN1
SCHEMBL19975880 0.97 CA1 (0.37) CA1CA2EEF2KEEF2MEN1
Hydrochloric Acid SCHEMBL19970402 0.95 CA1 (0.38) CA1CA2EEF2KEEF2MEN1
Hydrochloric Acid SCHEMBL19970405 0.95 CA1 (0.38) CA1CA2EEF2KEEF2MEN1

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-20180078477-A1 Method of Coloring Hair with Washfast Yellow Imidazolium Direct Dye Compounds WELLA OPERATIONS US, LLC 2018-03-22 US disclosed
US-9918919-B1 Method of coloring hair with washfast yellow imidazolium direct dye compounds NOXELL CORPORATION (US) 2018-03-20 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-20180078477-A1 Method of Coloring Hair with Washfast Yellow Imidazolium Direct Dye Compounds WASHC4, TYR, WASHC5 CA1 1121/4885CA2 920/4885EEF2K 4104/4885

“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.