SCHEMBL6396188

SCHEMBL6396188

O=C(c1cc2ccccc2[nH]1)n1ccnc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.54
KDM4E B2RXH2 2/20 0.53
MAPT P10636 1/20 0.53
DAO P14920 1/20 0.53
HPGD P15428 1/20 0.53
SRD5A2 P31213 1/20 0.53
HSD17B10 Q99714 1/20 0.53
HRH4 Q9H3N8 4/20 0.52
HRH3 Q9Y5N1 1/20 0.52
POLB P06746 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MAP2K1 Q02750 1/20 0.51
IDO1 P14902 4/20 0.48
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
MAPK1 P28482 1/20 0.48
NAMPT P43490 1/20 0.47
AKR1C3 P42330 1/20 0.47
DRD3 P35462 2/20 0.47
DRD2 P14416 1/20 0.47

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
SCHEMBL12428148 0.82 ALDH1A1 (0.58) FLT3KDM4EHPGDHSD17B10HRH4
SCHEMBL9288910 0.82 CYP17A1 (0.44) KDM4EHSD17B10HRH4HRH3ALDH1A1
SCHEMBL12427429 0.81 ALDH1A1 (0.57) KDM4EMAPTHPGDHSD17B10HRH4
SCHEMBL771326 0.80 KDR (0.43) KDM4EMAPTHPGDHSD17B10HRH4
SCHEMBL6389593 0.79 PDGFRB (0.60) FLT3KDM4EHPGDHRH4IDO1
SCHEMBL9688648 0.77 HRH4 (0.49) FLT3KDM4EHRH4HRH3MAP2K1
SCHEMBL7380785 0.76 AHR (0.40) FLT3KDM4EHRH4MAP2K1IDO1
SCHEMBL29145094 0.75 HRH4 (0.52) MAPTHRH4MAP2K1DRD3DRD2
SCHEMBL25667602 0.75 HRH4 (0.59) FLT3KDM4EMAPTHRH4POLB
SCHEMBL10822252 0.73 KCNA6 (0.53) KDM4EHSD17B10SMN1; SMN2IDO1ALDH1A1

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-8362066-B2 Compounds and methods for treating protein folding disorders TREVENTIS CORPORATION (US) 2013-01-29 US disclosed
US-8362066-B2 Compounds and methods for treating protein folding disorders TREVENTIS CORPORATION (US) 2013-01-29 US disclosed
US-20100144821-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2010-06-10 US disclosed
US-20100144821-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2010-06-10 US disclosed
US-20050267303-A1 Cyclic indole and heteroindole derivatives and methods for making and using as pharmaceuticals ZENTARIS AG 2005-12-01 US disclosed
EP-1423393-A1 CYCLIC INDOLE AND HETEROINDOLE DERIVATIVES, THE PRODUCTION AND USE THEREOF AS MEDICAMENTS Zentaris GmbH (DE) 2004-06-02 EP disclosed
US-20040039197-A1 Cyclic indole and heteroindole derivatives and methods for making and using as pharmaceuticals WATERWORKS, INC. 2004-02-26 US disclosed
WO-2003020731-A1 CYCLIC INDOLE AND HETEROINDOLE DERIVATIVES, THE PRODUCTION AND USE THEREOF AS MEDICAMENTS ZENTARIS GMBH (DE) 2003-03-13 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 (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-20100144821-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS SNCA, MAPT, APP FLT3 4679/4885KDM4E 1608/4885MAPT 2/4885
US-20050267303-A1 Cyclic indole and heteroindole derivatives and methods for making and using as pharmaceuticals IDO1, IDO2, INMT FLT3 1155/4885KDM4E 3763/4885MAPT 226/4885
US-20040039197-A1 Cyclic indole and heteroindole derivatives and methods for making and using as pharmaceuticals IDO1, IDO2, INMT FLT3 1166/4885KDM4E 3807/4885MAPT 322/4885

“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.