SCHEMBL20906320

SCHEMBL20906320

OCCCOCCCOCCN(CCOCCCOCCCO)c1ccc(C(c2ccc(N(CCOCCCOCCCO)CCOCCCOCCCO)cc2)c2ccccn2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 7/20 0.43
SLC6A2 P23975 7/20 0.43
SLC6A4 P31645 7/20 0.43
LMNA P02545 3/20 0.41
ADRA2A P08913 2/20 0.41
CYP2C9 P11712 2/20 0.41
TSHR P16473 2/20 0.41
ADRA1A P35348 2/20 0.41
OPRK1 P41145 2/20 0.41
HIF1A Q16665 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ABCB11 O95342 1/20 0.41
ESR1 P03372 1/20 0.41
CYP3A4 P08684 1/20 0.41
PDE4A P27815 1/20 0.41
STAT6 P42226 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
AHR P35869 3/20 0.36
CHRM2 P08172 7/20 0.36
KCNH2 Q12809 6/20 0.36

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
SCHEMBL20909494 0.80 SLC6A3 (0.50) SLC6A3SLC6A2SLC6A4LMNAADRA2A
SCHEMBL20905898 0.76 NCF1 (0.35) KDM4E
SCHEMBL20906329 0.75 AHR (0.34) LMNAAHR
SCHEMBL20904085 0.72 CHRM2 (0.38) SLC6A3SLC6A2SLC6A4LMNAADRA2A
SCHEMBL5010074 0.72 SLC6A3 (0.58) SLC6A3SLC6A2SLC6A4LMNAADRA2A
SCHEMBL11185219 0.67 SLC6A3 (0.63) SLC6A3SLC6A2SLC6A4LMNAADRA2A
SCHEMBL18205003 0.66 APP (0.49) LMNATSHRCYP3A4L3MBTL1
SCHEMBL18216978 0.66 APP (0.49) LMNATSHRCYP3A4L3MBTL1
SCHEMBL3836181 0.66 APP (0.43) KDM4EL3MBTL1
Dihydroxydiphenyl-Pyridyl Methane SCHEMBL3615825 0.65 SLC6A3 (0.70) SLC6A3SLC6A2SLC6A4LMNAADRA2A

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-10889717-B2 Compositions, methods, and test kits for determining authenticity MILLIKEN & COMPANY (US) 2021-01-12 US disclosed
US-20190112551-A1 LAUNDRY CARE COMPOSITIONS, METHODS, AND TEST KITS FOR DETERMINING AUTHENTICITY THE PROCTER & GAMBLE COMPANY 2019-04-18 US disclosed
US-20190112484-A1 COMPOSITIONS, METHODS, AND TEST KITS FOR DETERMINING AUTHENTICITY MILLIKEN & COMPANY 2019-04-18 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-10889717-B2 Compositions, methods, and test kits for determining authenticity AHR, AR, ARSA SLC6A3 3565/4885SLC6A2 3665/4885SLC6A4 4321/4885

“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.