SCHEMBL9937464

SCHEMBL9937464

CCOC(=O)c1cccc(Nc2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.61
NPC1 O15118 3/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
KDM4E B2RXH2 1/20 0.61
CDC25B P30305 6/20 0.58
TP53 P04637 2/20 0.57
AKR1C3 P42330 1/20 0.57
AKR1C2 P52895 1/20 0.57
SYK P43405 1/20 0.55
ALDH1A1 P00352 2/20 0.55
KMT2A Q03164 2/20 0.55
TSHR P16473 1/20 0.55
CDC25A P30304 1/20 0.55
CDC25C P30307 1/20 0.55
HPGD P15428 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
POLB P06746 1/20 0.53
PKM P14618 1/20 0.53

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
SCHEMBL3627604 0.92 RAB9A (0.58) RAB9ANPC1SMN1; SMN2KDM4ECDC25B
SCHEMBL5141437 0.88 KMT2A (0.65) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL30786693 0.87 CES2 (0.61) ALDH1A1KMT2AHPGDPOLBMAPT
SCHEMBL1994068 0.87 CES2 (0.61) ALDH1A1KMT2AHPGDPOLBMAPT
SCHEMBL28007500 0.86 RAB9A (0.70) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL7107744 0.84 CDC25B (0.69) RAB9ANPC1SMN1; SMN2KDM4ECDC25B
SCHEMBL1356848 0.84 CDC25B (0.64) RAB9ANPC1SMN1; SMN2KDM4ECDC25B
SCHEMBL13243724 0.84 CDC25B (0.64) RAB9ANPC1SMN1; SMN2KDM4ECDC25B
SCHEMBL15054360 0.84 KIF11 (0.57) RAB9ANPC1SMN1; SMN2KDM4ETP53
SCHEMBL5179212 0.84 THRB (0.56) RAB9ANPC1SMN1; SMN2KDM4EALDH1A1

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 5 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
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 RAB9A 513/4885NPC1 250/4885SMN1; SMN2 12/4885

“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.