SCHEMBL1726285

SCHEMBL1726285

CCCCCCCCCCCCCCCNCCc1c[nH]c2ccccc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.71
MTNR1A P48039 2/20 0.65
MC5R P33032 1/20 0.64
MC3R P41968 1/20 0.64
MC1R Q01726 1/20 0.64
G6PD P11413 1/20 0.63
HTR1A P08908 3/20 0.61
KDM4E B2RXH2 1/20 0.61
ALDH1A1 P00352 1/20 0.61
HTT P42858 1/20 0.61
HTR1D P28221 1/20 0.60
HTR1B P28222 1/20 0.60
MPO P05164 1/20 0.60
BCHE P06276 1/20 0.55
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
CYP1A2 P05177 1/20 0.55
PKM P14618 1/20 0.55
TSHR P16473 1/20 0.55
CYP2C19 P33261 1/20 0.55

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
SCHEMBL1724528 1.00 HTR2A (0.71) HTR2AMTNR1AMC5RMC3RMC1R
SCHEMBL1725569 1.00 HTR2A (0.71) HTR2AMTNR1AMC5RMC3RMC1R
SCHEMBL1724670 1.00 HTR2A (0.71) HTR2AMTNR1AMC5RMC3RMC1R
SCHEMBL1726381 1.00 HTR2A (0.71) HTR2AMTNR1AMC5RMC3RMC1R
SCHEMBL1725374 1.00 HTR2A (0.71) HTR2AMTNR1AMC5RMC3RMC1R
SCHEMBL22411429 1.00 HTR2A (0.71) HTR2AMTNR1AMC5RMC3RMC1R
SCHEMBL14907395 1.00 HTR2A (0.71) HTR2AMTNR1AMC5RMC3RMC1R
SCHEMBL7022564 1.00 HTR2A (0.71) HTR2AMTNR1AMC5RMC3RMC1R
SCHEMBL1727120 1.00 HTR2A (0.71) HTR2AMTNR1AMC5RMC3RMC1R
SCHEMBL1325639 0.99 HTR2A (0.73) HTR2AMTNR1AMC5RMC3RMC1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8614246-B2 Indole derivatives for treating neurodegenerative diseases CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2013-12-24 US disclosed
CN-102369185-A Indole derivatives for treating neurodegenerative diseases CENTRE NAT RECH SCIENT 2012-03-07 CN 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20110319387-A1 INDOLE DERIVATIVES FOR TREATING NEURODEGENERATIVE DISEASES SNCA, TPH1, HCRTR1 HTR2A 91/4885MTNR1A 20/4885MC5R 214/4885

“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.