SCHEMBL3810079

SCHEMBL3810079

CCCCCCCCCCCCCCCCCCCC(=O)NCCc1c[nH]c2c(Cl)cccc12

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 7/20 0.69
TRPV1 Q8NER1 6/20 0.59
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
MTNR1B P49286 3/20 0.49
SLC6A4 P31645 1/20 0.49
HTR2A P28223 1/20 0.48
FAAH O00519 1/20 0.48
PTGS2 P35354 1/20 0.48

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
SCHEMBL3808158 0.94 TRPV1 (0.63) MTNR1ATRPV1FAAHPTGS2
SCHEMBL3808151 0.94 TRPV1 (0.63) MTNR1ATRPV1FAAHPTGS2
SCHEMBL20648088 0.88 MTNR1A (0.70) MTNR1ATRPV1MEN1KMT2AMTNR1B
SCHEMBL20648004 0.87 MTNR1A (0.69) MTNR1ATRPV1MEN1KMT2AMTNR1B
SCHEMBL3806274 0.82 MTNR1A (0.62) MTNR1ATRPV1MEN1KMT2AMTNR1B
SCHEMBL3806536 0.81 MTNR1A (1.00) MTNR1ATRPV1MEN1KMT2AMTNR1B
SCHEMBL1725354 0.81 MTNR1A (1.00) MTNR1ATRPV1MEN1KMT2AMTNR1B
SCHEMBL1727281 0.81 MTNR1A (1.00) MTNR1ATRPV1MEN1KMT2AMTNR1B
SCHEMBL1066221 0.81 MTNR1A (1.00) MTNR1ATRPV1MEN1KMT2AMTNR1B
SCHEMBL1724741 0.81 MTNR1A (1.00) MTNR1ATRPV1MEN1KMT2AMTNR1B

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-20170266161-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR MAKING THE SAME SIGNUM BIOSCIENCES, INC. (US) 2017-09-21 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
US-9486441-B2 Compounds, compositions and methods for making the same SIGNUM BIOSCIENCES, INC. (US) 2016-11-08 US disclosed
US-9486441-B2 Compounds, compositions and methods for making the same SIGNUM BIOSCIENCES, INC. (US) 2016-11-08 US disclosed
US-20090264496-A1 Compounds, Compositions and Methods for Making the Same SIGNUM BIOSCIENCES, INC. 2009-10-22 US disclosed
US-20090264496-A1 Compounds, Compositions and Methods for Making the Same SIGNUM BIOSCIENCES, INC. 2009-10-22 US 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 (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-20090264496-A1 Compounds, Compositions and Methods for Making the Same PPP2CA, PPP4C, PPP6C MTNR1A 1889/4885TRPV1 4687/4885MEN1 3072/4885
US-20170266161-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR MAKING THE SAME PPP2CA, PPP4C, PPP6C MTNR1A 1889/4885TRPV1 4687/4885MEN1 3072/4885

“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.