SCHEMBL15534701

SCHEMBL15534701

O=CNc1cccc(C(=O)Nc2ccc(C(=O)NC3CCCCCCCC3)cc2)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 1/20 0.50
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 3/20 0.47
RXFP1 Q9HBX9 1/20 0.47
NAMPT P43490 3/20 0.46
EPHX2 P34913 1/20 0.46
RAB9A P51151 7/20 0.45
NPC1 O15118 6/20 0.45
HPGD P15428 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C19 P33261 1/20 0.45
PKM P14618 1/20 0.44
LMNA P02545 2/20 0.44
HTT P42858 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 2/20 0.43
TYK2 P29597 1/20 0.43

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
SCHEMBL15536636 1.00 HTR2B (0.50) HTR2BMEN1KMT2AALDH1A1KDM4E
SCHEMBL8515079 0.87 ALDH1A1 (0.57) MEN1KMT2AALDH1A1KDM4ERAB9A
SCHEMBL15480774 0.87 ALDH1A1 (0.57) MEN1KMT2AALDH1A1KDM4ERAB9A
SCHEMBL15535350 0.87 ALDH1A1 (0.57) MEN1KMT2AALDH1A1KDM4ERAB9A
SCHEMBL15476462 0.87 ALDH1A1 (0.57) MEN1KMT2AALDH1A1KDM4ERAB9A
SCHEMBL15480784 0.87 ALDH1A1 (0.57) MEN1KMT2AALDH1A1KDM4ERAB9A
SCHEMBL15534635 0.87 ALDH1A1 (0.57) MEN1KMT2AALDH1A1KDM4ERAB9A
SCHEMBL15606278 0.83 KLK1 (0.38) MEN1KMT2AKDM4ERXFP1EPHX2
SCHEMBL17131952 0.79 NPC1 (0.72) HTR2BMEN1KMT2AALDH1A1KDM4E
SCHEMBL15480781 0.77 TAS1R3 (0.50) MEN1KMT2AALDH1A1KDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9458174-B2 Inhibitors of the activity of complex (III) of the mitochondrial electron transport chain and use thereof STEMERGIE BIOTECHNOLOGY SA (CH) 2016-10-04 US disclosed
US-9458174-B2 Inhibitors of the activity of complex (III) of the mitochondrial electron transport chain and use thereof STEMERGIE BIOTECHNOLOGY SA (CH) 2016-10-04 US disclosed
US-20150148301-A1 INHIBITORS OF THE ACTIVITY OF COMPLEX (III) OF THE MITOCHONDRIAL ELECTRON TRANSPORT CHAIN AND USE THEREOF Stemergie Biotechnology SA a corporation 2015-05-28 US disclosed
US-20150148301-A1 INHIBITORS OF THE ACTIVITY OF COMPLEX (III) OF THE MITOCHONDRIAL ELECTRON TRANSPORT CHAIN AND USE THEREOF Stemergie Biotechnology SA a corporation 2015-05-28 US disclosed
EP-2852439-A1 INHIBITORS OF THE ACTIVITY OF COMPLEX (III) OF THE MITOCHONDRIAL ELECTRON TRANSPORT CHAIN AND USE THEREOF Stemergie Biotechnology SA (CH) 2015-04-01 EP disclosed
WO-2013174947-A1 INHIBITORS OF THE ACTIVITY OF COMPLEX (III) OF THE MITOCHONDRIAL ELECTRON TRANSPORT CHAIN AND USE THEREOF STEMERGIE BIOTECHNOLOGY SA (CH) 2013-11-28 WO disclosed
WO-2013174947-A1 INHIBITORS OF THE ACTIVITY OF COMPLEX (III) OF THE MITOCHONDRIAL ELECTRON TRANSPORT CHAIN AND USE THEREOF STEMERGIE BIOTECHNOLOGY SA (CH) 2013-11-28 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-20150148301-A1 INHIBITORS OF THE ACTIVITY OF COMPLEX (III) OF THE MITOCHONDRIAL ELECTRON TRANSPORT CHAIN AND USE THEREOF NDUFB3, MT-CO3, SLC25A1 HTR2B 4751/4885MEN1 2932/4885KMT2A 3571/4885

“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.