SCHEMBL1724741

SCHEMBL1724741

CCCCCCCCCCCCCCCCCCCC(=O)NCCc1c[nH]c2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 1.00
MEN1 O00255 2/20 0.79
KMT2A Q03164 2/20 0.79
TRPV1 Q8NER1 5/20 0.73
AANAT Q16613 1/20 0.65
LMNA P02545 2/20 0.64
CYP1A2 P05177 1/20 0.64
PKM P14618 1/20 0.64
TSHR P16473 1/20 0.64
CYP2C19 P33261 1/20 0.64
BLM P54132 1/20 0.64
MAPT P10636 2/20 0.64
UBE2N P61088 1/20 0.64
ALDH1A1 P00352 1/20 0.62
MTNR1B P49286 2/20 0.61
GFER P55789 1/20 0.61

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
SCHEMBL29376485 1.00 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL1725354 1.00 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL1726070 1.00 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL1726502 1.00 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL3806536 1.00 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL1063483 1.00 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL1727281 1.00 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL1066221 1.00 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL22411433 1.00 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL1725127 1.00 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT

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 13 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-8614246-B2 Indole derivatives for treating neurodegenerative diseases CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2013-12-24 US disclosed
EP-2403830-A2 INDOLE DERIVATIVES FOR TREATING NEURODEGENERATIVE DISEASES Centre National de la Recherche Scientifique (CNRS) (FR) 2012-01-11 EP disclosed
US-20110319387-A1 INDOLE DERIVATIVES FOR TREATING NEURODEGENERATIVE DISEASES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2011-12-29 US disclosed
WO-2010100133-A2 INDOLE DERIVATIVES FOR TREATING NEURODEGENERATIVE DISEASES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2010-09-10 WO 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
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 (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 1889/4885MEN1 3072/4885KMT2A 121/4885
US-20110319387-A1 INDOLE DERIVATIVES FOR TREATING NEURODEGENERATIVE DISEASES SNCA, TPH1, HCRTR1 MTNR1A 20/4885MEN1 862/4885KMT2A 2307/4885
US-20170266161-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR MAKING THE SAME PPP2CA, PPP4C, PPP6C MTNR1A 1889/4885MEN1 3072/4885KMT2A 121/4885

“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.