SCHEMBL3482995

SCHEMBL3482995

[CH2]CN(C)C(=O)Oc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.52
ATM Q13315 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
KMT2A Q03164 5/20 0.49
ALDH1A1 P00352 4/20 0.49
PKM P14618 1/20 0.49
RAB9A P51151 5/20 0.48
SMN1; SMN2 Q16637 4/20 0.45
NPC1 O15118 3/20 0.45
MEN1 O00255 4/20 0.44
NPSR1 Q6W5P4 2/20 0.44
ABHD6 Q9BV23 1/20 0.44
ACHE P22303 4/20 0.43
FAAH O00519 1/20 0.43
BCHE P06276 1/20 0.43
NPY5R Q15761 1/20 0.43
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
GFER P55789 1/20 0.41

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
SCHEMBL12712356 0.83 BCHE (0.59) TDP1ATML3MBTL1KMT2AALDH1A1
SCHEMBL21802387 0.81 ATM (0.52) TDP1ATML3MBTL1KMT2AALDH1A1
SCHEMBL88870 0.81 KMT2A (0.48) TDP1ATML3MBTL1KMT2AALDH1A1
SCHEMBL9534399 0.80 ATM (0.50) TDP1ATML3MBTL1KMT2AALDH1A1
SCHEMBL31164812 0.80 NPC1 (0.61) TDP1ATML3MBTL1KMT2ARAB9A
SCHEMBL3475215 0.80 ACHE (0.61) TDP1ATML3MBTL1KMT2AALDH1A1
SCHEMBL10956942 0.79 L3MBTL1 (0.49) TDP1ATML3MBTL1KMT2AALDH1A1
SCHEMBL27308957 0.79 ATM (0.49) TDP1ATML3MBTL1KMT2AALDH1A1
Phenyl Dimethylcarbamate SCHEMBL491227 0.78 RAB9A (0.78) TDP1ATML3MBTL1KMT2AALDH1A1
SCHEMBL7194185 0.78 TDP1 (0.61) TDP1ATML3MBTL1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9006225-B2 Stable pharmaceutical composition ASAHI KASEI PHARMA CORPORATION (JP) 2015-04-14 US disclosed
EP-2236135-A1 STABLE PHARMACEUTICAL COMPOSITION Asahi Kasei Pharma Corporation (JP) 2010-10-06 EP disclosed
US-20100048893-A1 Substituted arylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2010-02-25 US disclosed
US-20100041725-A1 STABLE PHARMACEUTICAL COMPOSITION ASAHI KASEI PHARMA CORPORATION (JP) 2010-02-18 US disclosed
EP-2006271-A9 SUBSTITUTED BICYCLIC CYCLIC DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2009-07-29 EP disclosed
US-20090062530-A1 Substituted arylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2009-03-05 US disclosed
US-20090054401-A1 Substituted bicyclic derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2009-02-26 US disclosed
US-7470807-B2 Suppress production of both prostaglandins and leukotrienes and have reduced side effects; treatment of various inflammatory diseases, autoimmune diseases, allergic diseases, pain and fibrosis; for example, methyl 3-[3-acetylamino-4-cyclopentyloxy-5-(naphthalen-2-yl)phenyl]propionate ASAHI KASEI PHARMA CORPORATION (JP) 2008-12-30 US disclosed
EP-2006271-A2 SUBSTITUTED BICYCLIC CYCLIC DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2008-12-24 EP disclosed
US-20070213333-A1 Substituted arylalkanoic acid derivatives and use thereof ASAHI KASEI PHAMA CORPORATION (JP) 2007-09-13 US disclosed
CN-101031539-A Substituted arylalkanoic acid derivatives and use thereof ASAHI KASEI PHAMA CORP (JP) 2007-09-05 CN 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 (5 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-20090054401-A1 Substituted bicyclic derivatives and use thereof LTB4R2, LTC4S, LTB4R TDP1 4874/4885ATM 4161/4885L3MBTL1 2903/4885
US-20100048893-A1 Substituted arylalkanoic acid derivatives and use thereof CYSLTR1, CYSLTR2, LTB4R2 TDP1 4853/4885ATM 4355/4885L3MBTL1 3073/4885
US-20070213333-A1 Substituted arylalkanoic acid derivatives and use thereof CYSLTR1, CYSLTR2, LTB4R2 TDP1 4853/4885ATM 4355/4885L3MBTL1 3073/4885
US-20100041725-A1 STABLE PHARMACEUTICAL COMPOSITION SLC5A1, SLC5A2, SLC2A9 TDP1 3868/4885ATM 4053/4885L3MBTL1 4867/4885
US-20090062530-A1 Substituted arylalkanoic acid derivatives and use thereof CYSLTR1, CYSLTR2, LTB4R2 TDP1 4853/4885ATM 4355/4885L3MBTL1 3073/4885

“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.