SCHEMBL16273558

SCHEMBL16273558

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SLC6A5 Q9Y345 1/20 0.69
▸ EPHX2 P34913 3/20 0.54
▸ CNR1 P21554 4/20 0.51
▸ FAAH O00519 2/20 0.51
▸ CNR2 P34972 2/20 0.51
▸ SREBF2 Q12772 1/20 0.46
▸ HRH4 Q9H3N8 1/20 0.45
▸ HRH3 Q9Y5N1 1/20 0.45
▸ ITGB2 P05107 2/20 0.45
▸ ICAM1 P05362 2/20 0.45
▸ ITGAL P20701 2/20 0.45
▸ MAPT P10636 1/20 0.44
▸ SLC15A2 Q16348 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42

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
SCHEMBL17636914 0.93 SLC6A5 (0.59) SLC6A5EPHX2CNR1FAAHCNR2
SCHEMBL16870591 0.89 SLC6A5 (0.59) SLC6A5EPHX2CNR1FAAHCNR2
SCHEMBL26624581 0.89 SLC6A5 (0.89) SLC6A5EPHX2CNR1FAAHCNR2
SCHEMBL18329855 0.84 SLC6A5 (0.54) SLC6A5EPHX2CNR1FAAHCNR2
SCHEMBL29713992 0.84 SLC6A5 (0.77) SLC6A5EPHX2CNR1FAAHCNR2
SCHEMBL16070708 0.84 SLC6A5 (0.77) SLC6A5EPHX2CNR1FAAHCNR2
SCHEMBL26624821 0.83 SLC6A5 (0.64) SLC6A5EPHX2CNR1FAAHCNR2
SCHEMBL16273559 0.82 SLC6A5 (0.57) SLC6A5EPHX2CNR1FAAHCNR2
SCHEMBL20398904 0.82 SLC6A5 (1.00) SLC6A5EPHX2CNR1FAAHCNR2
SCHEMBL20398906 0.82 SLC6A5 (1.00) SLC6A5EPHX2CNR1FAAHCNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9174931-B2 Compositions for the treatment of diabetes and pre-diabetes CELLIX BIO PRIVATE LIMITED (IN) 2015-11-03 — — US disclosed
US-20150183728-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DIABETES AND PRE-DIABETES CELLIX BIO PRIVATE LIMITED (IN) 2015-07-02 — — US disclosed
US-8952068-B2 Compositions for the treatment of diabetes and pre-diabetes CELLIXBIO PRIVATE LIMITED (IN) 2015-02-10 — — US disclosed
US-20140357680-A1 COMPOSITIONS FOR THE TREATMENT OF DIABETES AND PRE-DIABETES CELLIXBIO PRIVATE LIMITED (IN) 2014-12-04 — — 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-20150183728-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DIABETES AND PRE-DIABETES SLC5A1, GPR119, INSR SLC6A5 63/4885EPHX2 3867/4885CNR1 2599/4885
US-20140357680-A1 COMPOSITIONS FOR THE TREATMENT OF DIABETES AND PRE-DIABETES SLC5A1, INSR, GPR119 SLC6A5 45/4885EPHX2 4094/4885CNR1 2635/4885

“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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