SCHEMBL9938980

SCHEMBL9938980

COC(=O)c1ccc(Cc2cccc(F)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
MAPT P10636 2/20 0.56
MRGPRX4 Q96LA9 1/20 0.56
LOXL2 Q9Y4K0 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.49
POLB P06746 1/20 0.49
CTDSP1 Q9GZU7 1/20 0.49
LMNA P02545 2/20 0.49
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
MAPK1 P28482 2/20 0.49
MAOB P27338 2/20 0.49
CA12 O43570 1/20 0.49
CA9 Q16790 1/20 0.49
CA14 Q9ULX7 1/20 0.49
TP53 P04637 1/20 0.48
CYP4A11 Q02928 2/20 0.48

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
SCHEMBL9938380 0.89 MRGPRX4 (0.68) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL16709809 0.85 SMN1; SMN2 (0.54) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL25980248 0.85 CYP4A11 (0.61) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL2515139 0.85 LOXL2 (0.60) KMT2AMEN1RAB9AMAPTMRGPRX4
Hydrochloric Acid SCHEMBL20608510 0.84 CYP4A11 (0.60) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL481113 0.83 LOXL2 (0.56) NPC1RAB9AMAPTLOXL2SMN1; SMN2
SCHEMBL8993120 0.83 MAPT (0.56) KMT2AMEN1RAB9AMAPTLOXL2
SCHEMBL9937243 0.83 MRGPRX4 (0.54) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL9938816 0.82 MAOB (0.50) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL6158387 0.82 TSHR (0.67) NPC1RAB9AMAPTLOXL2SMN1; SMN2

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 6 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
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

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 KMT2A 3795/4885MEN1 704/4885NPC1 250/4885

“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.