SCHEMBL16429160

SCHEMBL16429160

CCCCCCCCNCCCNC(CCN)Cc1cc(CC(CCN)NCCCNCCCCCCCC)cc(-c2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 9/20 0.46
▸ CHRNB2 P17787 2/20 0.41
▸ CHRNB4 P30926 2/20 0.41
▸ CHRNA3 P32297 2/20 0.41
▸ CHRNA4 P43681 2/20 0.41
▸ TLR2 O60603 1/20 0.40
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ GRIA1 P42261 1/20 0.37
▸ HRH4 Q9H3N8 1/20 0.36
▸ HRH3 Q9Y5N1 1/20 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
SCHEMBL16429225 1.00 SIGMAR1 (0.46) SIGMAR1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL16429269 0.95 SIGMAR1 (0.45) SIGMAR1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL16429220 0.94 SIGMAR1 (0.45) SIGMAR1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL16429108 0.89 CHRNB2 (0.39) SIGMAR1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL16428820 0.87 SIGMAR1 (0.48) SIGMAR1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL16428822 0.87 SIGMAR1 (0.48) SIGMAR1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL16428818 0.85 SIGMAR1 (0.39) SIGMAR1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL16429323 0.85 MAOA (0.42) SIGMAR1MEN1KMT2A
SCHEMBL16428941 0.84 SIGMAR1 (0.43) SIGMAR1MEN1KMT2A
Hydrochloric Acid SCHEMBL16247175 0.83 SIGMAR1 (0.42) SIGMAR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10440955-B2 Methods comprising a biocidal polyamine CURZA GLOBAL, LLC (US) 2019-10-15 — — US disclosed
US-20180125070-A1 COMPOSITIONS AND METHODS COMPRISING A BIOCIDAL POLYAMINE THE UNIVERSITY OF UTAH 2018-05-10 — — US disclosed
US-9839219-B2 Compositions comprising a biocidal polyamine CURZA GLOBAL, LLC (US) 2017-12-12 — — US disclosed
US-20160330962-A1 COMPOSITIONS COMPRISING A BIOCIDAL POLYAMINE CURZA GLOBAL, LLC 2016-11-17 — — US disclosed
US-9439433-B2 Compositions and methods comprising a biocidal polyamine CURZA GLOBAL, LLC (US) 2016-09-13 — — US disclosed
US-20150038512-A1 COMPOSITIONS AND METHODS COMPRISING A BIOCIDAL POLYAMINE THE UNIVERSITY OF UTAH 2015-02-05 — — 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 (4 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-20160330962-A1 COMPOSITIONS COMPRISING A BIOCIDAL POLYAMINE SRM, SMS, SMOX SIGMAR1 1551/4885CHRNB2 4820/4885CHRNB4 4831/4885
US-10440955-B2 Methods comprising a biocidal polyamine SRM, SMOX, SMS SIGMAR1 1642/4885CHRNB2 4798/4885CHRNB4 4816/4885
US-20180125070-A1 COMPOSITIONS AND METHODS COMPRISING A BIOCIDAL POLYAMINE SRM, SMOX, SMS SIGMAR1 1771/4885CHRNB2 4818/4885CHRNB4 4839/4885
US-20150038512-A1 COMPOSITIONS AND METHODS COMPRISING A BIOCIDAL POLYAMINE SRM, SMOX, SMS SIGMAR1 1771/4885CHRNB2 4818/4885CHRNB4 4839/4885

“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.

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