SCHEMBL15535834

SCHEMBL15535834

O=CNc1cccc(C(=O)NC2CCCCCCCC2)c1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.62
NPC1 O15118 4/20 0.62
L3MBTL1 Q9Y468 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.58
PKM P14618 2/20 0.58
KDM4E B2RXH2 1/20 0.58
GFER P55789 1/20 0.58
HSD17B10 Q99714 1/20 0.58
HPGD P15428 1/20 0.57
HTR2B P41595 1/20 0.57
ERN1 O75460 1/20 0.56
ALOX15 P16050 1/20 0.54
KDM1A O60341 1/20 0.53
LMNA P02545 1/20 0.52
HTT P42858 1/20 0.52
ANO1 Q5XXA6 2/20 0.52
SMYD3 Q9H7B4 1/20 0.51

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
SCHEMBL6707186 0.83 RAB9A (0.79) RAB9ANPC1L3MBTL1SMN1; SMN2PKM
SCHEMBL9265040 0.83 RAB9A (0.79) RAB9ANPC1L3MBTL1SMN1; SMN2PKM
SCHEMBL13105707 0.83 RAB9A (0.69) RAB9ANPC1L3MBTL1SMN1; SMN2PKM
SCHEMBL4262114 0.82 RAB9A (0.63) RAB9ANPC1L3MBTL1SMN1; SMN2PKM
SCHEMBL25843275 0.81 NPC1 (0.59) RAB9ANPC1SMN1; SMN2KDM4EHPGD
SCHEMBL24166611 0.81 NPC1 (0.62) RAB9ANPC1L3MBTL1SMN1; SMN2PKM
SCHEMBL22930836 0.80 NPC1 (0.58) RAB9ANPC1L3MBTL1SMN1; SMN2PKM
SCHEMBL19445791 0.79 RAB9A (0.72) RAB9ANPC1L3MBTL1SMN1; SMN2PKM
SCHEMBL20888434 0.78 L3MBTL1 (0.60) RAB9ANPC1L3MBTL1SMN1; SMN2PKM
SCHEMBL12852598 0.78 RAB9A (0.62) RAB9ANPC1L3MBTL1SMN1; SMN2PKM

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 RAB9A 2795/4885NPC1 825/4885L3MBTL1 4262/4885

“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.