SCHEMBL1129997

SCHEMBL1129997

CCCC(CCC)C(=O)NCCc1c[nH]c2ccc(Cl)cc12

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.69
MTNR1B P49286 1/20 0.69
TSHR P16473 1/20 0.68
MMP9 P14780 1/20 0.63
MMP8 P22894 1/20 0.63
MMP14 P50281 1/20 0.63
SNCA P37840 12/20 0.60
GFER P55789 1/20 0.60
HSD17B10 Q99714 1/20 0.60
ABCG2 Q9UNQ0 1/20 0.59
SPR P35270 1/20 0.58
HPGD P15428 1/20 0.57
PTGS1 P23219 1/20 0.56
PTGS2 P35354 1/20 0.56

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
SCHEMBL1129797 0.89 MTNR1A (0.64) MTNR1AMTNR1BTSHRMMP9MMP8
SCHEMBL1130185 0.87 MTNR1A (0.68) MTNR1AMTNR1BSNCAGFERSPR
SCHEMBL4510886 0.82 MTNR1A (1.00) MTNR1AMTNR1BTSHRMMP9MMP8
SCHEMBL28872536 0.80 MTNR1A (0.77) MTNR1AMTNR1BTSHRMMP9MMP8
SCHEMBL625920 0.79 MTNR1A (0.76) MTNR1AMTNR1BTSHRMMP9MMP8
SCHEMBL31293135 0.79 MTNR1A (0.72) MTNR1AMTNR1BTSHRMMP9MMP8
SCHEMBL892461 0.78 MMP9 (0.79) MTNR1AMTNR1BTSHRMMP9MMP8
SCHEMBL892597 0.78 MMP9 (0.79) MTNR1AMTNR1BTSHRMMP9MMP8
SCHEMBL1129949 0.78 MTNR1A (0.70) MTNR1AMTNR1BHSD17B10HPGD
SCHEMBL32678267 0.77 MTNR1A (0.73) MTNR1AMTNR1BTSHRMMP9MMP8

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
EP-2282735-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR MAKING THE SAME Signum Biosciences, Inc. (US) 2011-02-16 EP claimed
WO-2009132051-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR MAKING THE SAME SIGNUM BIOSCIENCES, INC. (US) 2009-10-29 WO claimed
US-10583119-B2 Compounds, compositions and methods for making the same SIGNUM BIOSCIENCES, INC. (US) 2020-03-10 US disclosed
US-20170266161-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR MAKING THE SAME SIGNUM BIOSCIENCES, INC. (US) 2017-09-21 US disclosed
US-9486441-B2 Compounds, compositions and methods for making the same SIGNUM BIOSCIENCES, INC. (US) 2016-11-08 US disclosed
EP-2282735-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR MAKING THE SAME Signum Biosciences, Inc. (US) 2011-02-16 EP disclosed
WO-2009132051-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR MAKING THE SAME SIGNUM BIOSCIENCES, INC. (US) 2009-10-29 WO disclosed
US-20090264496-A1 Compounds, Compositions and Methods for Making the Same SIGNUM BIOSCIENCES, INC. 2009-10-22 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 (3 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-20090264496-A1 Compounds, Compositions and Methods for Making the Same PPP2CA, PPP4C, PPP6C MTNR1A 1889/4885MTNR1B 2090/4885TSHR 3808/4885
US-20170266161-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR MAKING THE SAME PPP2CA, PPP4C, PPP6C MTNR1A 1889/4885MTNR1B 2090/4885TSHR 3808/4885
US-10583119-B2 Compounds, compositions and methods for making the same PPP2CA, PPP4C, PPP6C MTNR1A 1889/4885MTNR1B 2090/4885TSHR 3808/4885

“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.