SCHEMBL4495071

SCHEMBL4495071

CN(C)c1ccc2cc(-c3nc4cc(Cl)ccc4o3)c(=O)oc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.49
NPC1 O15118 7/20 0.49
RAB9A P51151 7/20 0.49
ALDH1A1 P00352 6/20 0.49
CASP3 P42574 4/20 0.49
SENP7 Q9BQF6 3/20 0.49
SENP6 Q9GZR1 2/20 0.49
SENP8 Q96LD8 1/20 0.49
SLC16A3 O15427 1/20 0.49
MAPT P10636 9/20 0.48
THRB P10828 1/20 0.48
SMN1; SMN2 Q16637 6/20 0.48
HPGD P15428 4/20 0.48
GAA P10253 2/20 0.48
TP53 P04637 1/20 0.48
GLA P06280 1/20 0.48
PKM P14618 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48
HSD17B10 Q99714 1/20 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
SCHEMBL31388377 0.88 MAPT (0.64) KDM4ENPC1RAB9AALDH1A1SLC16A3
SCHEMBL2389126 0.88 MAPT (0.64) KDM4ENPC1RAB9AALDH1A1SLC16A3
SCHEMBL4505226 0.84 MAPT (0.69) KDM4ENPC1RAB9AALDH1A1SLC16A3
SCHEMBL25997308 0.82 MAPT (0.44) KDM4ENPC1RAB9AALDH1A1CASP3
SCHEMBL25997312 0.82 MAPT (0.42) KDM4ENPC1RAB9AALDH1A1CASP3
SCHEMBL20917468 0.82 KDM4E (0.51) KDM4ENPC1RAB9AALDH1A1CASP3
SCHEMBL30165796 0.82 KDM4E (0.51) KDM4ENPC1RAB9AALDH1A1CASP3
SCHEMBL25997345 0.81 AGPAT2 (0.53) KDM4ENPC1RAB9AALDH1A1CASP3
SCHEMBL11210328 0.81 MAPT (0.63) KDM4ENPC1RAB9AALDH1A1CASP3
SCHEMBL22371414 0.81 MAPT (0.47) KDM4ENPC1RAB9AALDH1A1SLC16A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050169837-A1 Coumarines useful as biomarkers NOVARTIS AG (CH) 2005-08-04 US claimed
CN-1628114-A Coumarines useful as biomarkers NOVARTIS AG (CH) 2005-06-15 CN claimed
EP-1483262-A1 COUMARINES USEFUL AS BIOMARKERS Novartis AG (CH) 2004-12-08 EP claimed
WO-2003074519-A1 COUMARINES USEFUL AS BIOMARKERS NOVARTIS AG (CH) 2003-09-12 WO claimed
US-RE47689-E1 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2019-11-05 US disclosed
EP-2797592-B1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS INC (US) 2019-08-28 EP disclosed
US-9617268-B2 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2017-04-11 US disclosed
WO-2015095449-A1 METHODS FOR MODULATING THE AMOUNT RNA TRANSCRIPTS PTC THERAPEUTICS, INC. (US) 2015-06-25 WO disclosed
US-20150119380-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY F. HOFFMANN-LA ROCHE AG (CH) 2015-04-30 US disclosed
EP-2797592-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC Therapeutics, Inc. (US) 2014-11-05 EP disclosed
WO-2013101974-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS, INC. (US) 2013-07-04 WO disclosed
US-7569337-B2 Labeling brain tissues in vivo or in vitro; 3-Benzothiazol-2-yl-7-[4-(2-fluoro-ethyl)-piperazin-1-yl]-chromen-2-one; diagnosis, monitoring the effectiveness of a therapeutic treatment and detecting histopathological hallmarks of Alzheimer's disease NOVARTIS AG (CH) 2009-08-04 US disclosed
US-20050169837-A1 Coumarines useful as biomarkers NOVARTIS AG (CH) 2005-08-04 US disclosed
CN-1628114-A Coumarines useful as biomarkers NOVARTIS AG (CH) 2005-06-15 CN disclosed
EP-1483262-A1 COUMARINES USEFUL AS BIOMARKERS Novartis AG (CH) 2004-12-08 EP disclosed
WO-2003074519-A1 COUMARINES USEFUL AS BIOMARKERS NOVARTIS AG (CH) 2003-09-12 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 (2 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-20050169837-A1 Coumarines useful as biomarkers CCNB1, CBR1, CYP1A1 KDM4E 2497/4885NPC1 492/4885RAB9A 2178/4885
US-20150119380-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY SMN1; SMN2, RBM17, RBM22 KDM4E 829/4885NPC1 4329/4885RAB9A 3292/4885

“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.