SCHEMBL12458461

SCHEMBL12458461

CCCCCCCC/C=C/CCCCCCCCN(CCCN)CCOCCOCCN(CCCN)CCCCCCCC/C=C/CCCCCCCC

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
CNR1 P21554 1/20 0.38
FAAH O00519 3/20 0.38
TRPV1 Q8NER1 1/20 0.38
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
SOAT1 P35610 1/20 0.38
KMT2A Q03164 1/20 0.38
LPAR1 Q92633 1/20 0.37
LPAR2 Q9HBW0 1/20 0.37
LPAR3 Q9UBY5 1/20 0.37

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
SCHEMBL10065902 1.00 SLC6A5 (0.38) SLC6A5ALDH1A1MAPTTHRBCNR1
SCHEMBL10066198 1.00 SLC6A5 (0.38) SLC6A5ALDH1A1MAPTTHRBCNR1
SCHEMBL13679072 1.00 SLC6A5 (0.38) SLC6A5ALDH1A1MAPTTHRBCNR1
SCHEMBL14597544 0.98 SLC6A5 (0.38) SLC6A5ALDH1A1MAPTTHRBCNR1
SCHEMBL14597545 0.98 SLC6A5 (0.38) SLC6A5ALDH1A1MAPTTHRBCNR1
SCHEMBL12458464 0.88 FAAH (0.47) SLC6A5ALDH1A1FAAHTRPV1MEN1
SCHEMBL13950225 0.88 FAAH (0.47) SLC6A5ALDH1A1FAAHTRPV1MEN1
SCHEMBL4166859 0.88 FAAH (0.47) SLC6A5ALDH1A1FAAHTRPV1MEN1
SCHEMBL4161692 0.88 FAAH (0.47) SLC6A5ALDH1A1FAAHTRPV1MEN1
SCHEMBL10065892 0.88 FAAH (0.47) SLC6A5ALDH1A1FAAHTRPV1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9358300-B2 Transfection reagents Life Technologies Corporation (US) 2016-06-07 US disclosed
US-20150190522-A1 TRANSFECTION REAGENTS LIFE TECHNOLOGIES CORP (US) 2015-07-09 US disclosed
US-8785200-B2 Transfection reagents Life Technologies Corporation (US) 2014-07-22 US disclosed
US-20120238747-A1 TRANSFECTION REAGENTS Life Technologies Corporation (US) 2012-09-20 US disclosed
US-7601872-B2 Transfection reagents Life Technologies Corporation (US) 2009-10-13 US disclosed
US-7479573-B2 Transfection reagents INVITROGEN CORPORATION (US) 2009-01-20 US disclosed
US-7173154-B2 Transfection reagents INVITROGEN CORP. (US) 2007-02-06 US disclosed
US-7166745-B1 Transfection reagents INVITROGEN CORPORATION (US) 2007-01-23 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 (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-20120238747-A1 TRANSFECTION REAGENTS CPS1, PHAX, HNRNPH3 SLC6A5 336/4885ALDH1A1 3929/4885MAPT 4698/4885
US-20150190522-A1 TRANSFECTION REAGENTS CPS1, PHAX, HNRNPH3 SLC6A5 351/4885ALDH1A1 4021/4885MAPT 4696/4885

“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.