SCHEMBL7107744

SCHEMBL7107744

CCOC(=O)c1cccc(Nc2ccccc2)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 6/20 0.69
SMN1; SMN2 Q16637 5/20 0.68
RAB9A P51151 4/20 0.68
NPC1 O15118 3/20 0.68
KDM4E B2RXH2 1/20 0.68
MAPT P10636 8/20 0.64
LMNA P02545 3/20 0.64
MAPK1 P28482 1/20 0.64
HSD17B10 Q99714 1/20 0.64
TP53 P04637 5/20 0.64
THRB P10828 1/20 0.64
POLB P06746 3/20 0.63
PKM P14618 1/20 0.63
KMT2A Q03164 3/20 0.62
ALDH1A1 P00352 1/20 0.62
TSHR P16473 1/20 0.62
MEN1 O00255 2/20 0.61
CDC25A P30304 1/20 0.60
CDC25C P30307 1/20 0.60
CYP1A2 P05177 1/20 0.59

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
SCHEMBL28141853 0.92 RAB9A (0.67) CDC25BSMN1; SMN2RAB9ANPC1KDM4E
SCHEMBL1170135 0.91 RAB9A (0.65) CDC25BSMN1; SMN2RAB9ANPC1KDM4E
SCHEMBL27334690 0.88 SMN1; SMN2 (0.62) CDC25BSMN1; SMN2RAB9ANPC1KDM4E
SCHEMBL28142629 0.88 SMN1; SMN2 (0.59) CDC25BSMN1; SMN2RAB9ANPC1KDM4E
SCHEMBL9176722 0.85 SMN1; SMN2 (0.72) SMN1; SMN2RAB9ANPC1KDM4EMAPT
SCHEMBL3627604 0.85 RAB9A (0.58) CDC25BSMN1; SMN2RAB9ANPC1KDM4E
SCHEMBL6793571 0.85 RAB9A (0.76) SMN1; SMN2RAB9ANPC1MAPTLMNA
SCHEMBL9937464 0.84 RAB9A (0.61) CDC25BSMN1; SMN2RAB9ANPC1KDM4E
SCHEMBL584215 0.84 KMT2A (0.65) CDC25BSMN1; SMN2RAB9ANPC1KDM4E
SCHEMBL1745412 0.83 RAB9A (0.71) SMN1; SMN2RAB9ANPC1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651888-B1 N-((1H-indol-3-yl)-alkyl)-4-benzyl)benzamide and N-((1H-pyrrolo[2,3-b]pyridin-3-yl)-alkyl)-4-benzyl)benzamide derivatives as alpha synuclein aggregation inhibitors for the treatment of neurodegenerative disorders UNIV LEUVEN KATH (BE) 2017-05-17 EP disclosed
CN-103261156-B For treating the noval chemical compound of neurodegenerative disease 鲁汶天主教大学研究开发部 2016-12-28 CN disclosed
US-9266832-B2 Compounds for the treatment of neurodegenerative diseases Katholieke Universiteit Levun (BE) 2016-02-23 US disclosed
EP-2651888-A1 NEW COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES Katholieke Universiteit Leuven K.U. Leuven R&D (BE) 2013-10-23 EP disclosed
US-20130274260-A1 NEW COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES REMYND (BE) 2013-10-17 US disclosed
CN-103261156-A New compounds for the treatment of neurodegenerative diseases LEUVEN K U RES & DEV 2013-08-21 CN disclosed
WO-2012080221-A1 NEW COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) 2012-06-21 WO disclosed
EP-1485485-A1 TRANSDIFFERENTIATION OF CELLS AND TISSUES UNIVERSITY OF BATH (GB) 2004-12-15 EP disclosed
WO-2003078636-A1 TRANSDIFFERENTIATION OF CELLS AND TISSUES THE UNIVERSITY OF BATH (GB) 2003-09-25 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-20130274260-A1 NEW COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, MAPT, PSEN1 CDC25B 1933/4885SMN1; SMN2 12/4885RAB9A 513/4885

“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.