SCHEMBL6549189

SCHEMBL6549189

C=CCNCCC[N+](C)(C)CCCCCCCC

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.54
DNM1 Q05193 10/20 0.52
KMT2A Q03164 1/20 0.45
HSP90AA1 P07900 2/20 0.44
RAD52 P43351 2/20 0.44
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
PLA2G1B P04054 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
LMNA P02545 2/20 0.40
FAAH O00519 1/20 0.39
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL4782686 0.89 DNM1 (0.43) HTTDNM1KMT2ACNR1CNR2
SCHEMBL19630714 0.83 DNM1 (0.40) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL7534332 0.82 TSHR (0.55) CNR1CNR2FAAH
SCHEMBL7540762 0.82 TSHR (0.55) CNR1CNR2FAAH
SCHEMBL7540736 0.82 TSHR (0.55) CNR1CNR2FAAH
SCHEMBL817870 0.82 TSHR (0.55) CNR1CNR2FAAH
SCHEMBL7535052 0.82 TSHR (0.55) CNR1CNR2FAAH
SCHEMBL7533182 0.82 TSHR (0.55) CNR1CNR2FAAH
SCHEMBL3261321 0.82 TSHR (0.55) CNR1CNR2FAAH
SCHEMBL7539638 0.82 TSHR (0.55) CNR1CNR2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1014999-B1 CATIONIC POLYMERS AS TOXIN-BINDING AGENTS GENZYME CORP (US) 2004-12-08 EP claimed
EP-1014999-A1 CATIONIC POLYMERS AS TOXIN-BINDING AGENTS GELTEX PHARMACEUTICALS, INC. (US) 2000-07-05 EP claimed
WO-1999015186-A1 CATIONIC POLYMERS AS TOXIN-BINDING AGENTS GELTEX PHARMACEUTICALS, INC. (US) 1999-04-01 WO claimed
EP-1014999-B1 CATIONIC POLYMERS AS TOXIN-BINDING AGENTS GENZYME CORP (US) 2004-12-08 EP disclosed
US-6692732-B2 Administering cationic polymers to mammals to prevent poisons or antigens from microorganisms such as bacteria, viruses, fungi or parasites; deactivation GENZYME CORPORATION 2004-02-17 US disclosed
US-20040009145-A1 IONIC POLYMERS AS TOXIN-BINDING AGENTS GELTEX PHARMACEUTICALS, INC. 2004-01-15 US disclosed
US-6482402-B1 BACTERICIDE AND CATIONIC POLYMER GELTEX PHARMACEUTICALS, INC. 2002-11-19 US disclosed
US-20020114774-A1 Ionic polymers as toxin-binding agents GELTEX PHARMACEUTICALS, INC. 2002-08-22 US disclosed
US-6290947-B1 IN ONE EMBODIMENT, THE POLYMER IS A COPOLYMER COMPRISING A MONOMER HAVING A PENDANT AMMONIUM GROUP AND A HYDROPHOBIC MONOMER. GELTEX PHARMACEUTICALS, INC. 2001-09-18 US disclosed
EP-1014999-A1 CATIONIC POLYMERS AS TOXIN-BINDING AGENTS GELTEX PHARMACEUTICALS, INC. (US) 2000-07-05 EP disclosed
US-6007803-A ADMINISTERING TO MAMMAL A CATIONIC POLYMER TO INHIBIT PATHOGENIC TOXINS GELTEX PHARMACEUTICALS, INC. (US) 1999-12-28 US disclosed
WO-1999015186-A1 CATIONIC POLYMERS AS TOXIN-BINDING AGENTS GELTEX PHARMACEUTICALS, INC. (US) 1999-04-01 WO 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 (2 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-20020114774-A1 Ionic polymers as toxin-binding agents PIGS, ANTXR2, MSN HTT 166/4885DNM1 424/4885KMT2A 3812/4885
US-20040009145-A1 IONIC POLYMERS AS TOXIN-BINDING AGENTS PIGS, ANTXR2, MSN HTT 166/4885DNM1 424/4885KMT2A 3812/4885

“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.