SCHEMBL9938018

SCHEMBL9938018

CCOC(=O)c1cccc(Nc2cccc(C#N)c2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.63
RAB9A P51151 5/20 0.63
NPC1 O15118 4/20 0.63
KDM4E B2RXH2 1/20 0.63
CDC25B P30305 6/20 0.57
TP53 P04637 3/20 0.56
CYP1A2 P05177 1/20 0.55
CYP2C9 P11712 1/20 0.55
HPGD P15428 1/20 0.55
CYP2C19 P33261 1/20 0.55
KMT2A Q03164 3/20 0.54
ALDH1A1 P00352 2/20 0.54
TSHR P16473 1/20 0.54
MAPT P10636 6/20 0.54
MEN1 O00255 2/20 0.54
SETD7 Q8WTS6 1/20 0.53
POLB P06746 3/20 0.52
PKM P14618 1/20 0.52
LMNA P02545 3/20 0.51
THRB P10828 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
SCHEMBL1505251 0.87 GSK3B (0.55) SMN1; SMN2RAB9ANPC1CYP1A2CYP2C9
SCHEMBL5928256 0.86 RAB9A (0.52) SMN1; SMN2RAB9ANPC1TP53CYP1A2
SCHEMBL1357593 0.85 CDC25B (0.62) SMN1; SMN2RAB9ANPC1KDM4ECDC25B
SCHEMBL7107744 0.83 CDC25B (0.69) SMN1; SMN2RAB9ANPC1KDM4ECDC25B
SCHEMBL4445717 0.82 TLR8 (0.54) TP53HPGDPOLB
SCHEMBL28141853 0.82 RAB9A (0.67) SMN1; SMN2RAB9ANPC1KDM4ECDC25B
SCHEMBL1356910 0.81 KMT2A (0.53) SMN1; SMN2RAB9ANPC1KDM4ECDC25B
SCHEMBL4107154 0.81 TRPV1 (0.68) SMN1; SMN2RAB9ANPC1KMT2AALDH1A1
SCHEMBL1170135 0.81 RAB9A (0.65) SMN1; SMN2RAB9ANPC1KDM4ECDC25B
SCHEMBL5417221 0.81 SETD7 (0.52) SMN1; SMN2RAB9ANPC1KDM4ECDC25B

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
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

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 SMN1; SMN2 12/4885RAB9A 513/4885NPC1 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.