SCHEMBL13851324

SCHEMBL13851324

CN(C)c1cc[n+](Cc2ccc(C[n+]3ccc(-c4cc[n+](CCP(=O)(O)O)cc4)cc3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CHKA P35790 15/20 0.58
▸ ALDH1A1 P00352 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ HTT P42858 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ CHKB Q9Y259 1/20 0.43

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
SCHEMBL13851325 0.82 CHKA (0.53) CHKAALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL13851328 0.81 ALDH1A1 (0.53) CHKAALDH1A1LMNAHTTSMN1; SMN2
Bromide SCHEMBL3361424 0.80 ALDH1A1 (0.51) CHKAALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL1226951 0.78 MEN1 (0.39) ALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL17384186 0.77 ALDH1A1 (0.49) CHKAALDH1A1LMNAHTTSMN1; SMN2
Bromide SCHEMBL918125 0.77 MEN1 (0.38) CHKAALDH1A1LMNAHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL210855 0.77 MEN1 (0.38) ALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL1108058 0.74 CHKA (1.00) CHKAALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL13974630 0.74 SLC6A4 (0.42) LMNAHTTSMN1; SMN2
SCHEMBL9889761 0.74 MEN1 (0.41) ALDH1A1LMNAHTTSMN1; SMN2

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-20090137807-A1 Electrochromic material with improved lifetime LG CHEM, LTD. (KR) 2009-05-28 — — US disclosed
US-7521005-B2 Electrochromic material with improved lifetime LG CHEM, LTD. (KR) 2009-04-21 — — 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-20090137807-A1 Electrochromic material with improved lifetime CCNE2, NFE2L2, NQO1 CHKA 4371/4885ALDH1A1 3177/4885LMNA 3793/4885

“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.

Send feedback