SCHEMBL2060593

SCHEMBL2060593

O=C(Nc1ccccc1)C(=O)Nc1ccc(C2CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 1/20 0.56
IDO1 P14902 2/20 0.55
HDAC3 O15379 1/20 0.54
HDAC11 Q96DB2 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
TP53 P04637 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
MEN1 O00255 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
GFER P55789 1/20 0.50
KMT2A Q03164 1/20 0.50
NAMPT P43490 2/20 0.49
TSHR P16473 2/20 0.48
PKM P14618 1/20 0.47
HPGD P15428 1/20 0.47
PTPN1 P18031 1/20 0.47

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
SCHEMBL2565768 0.82 HDAC3 (0.73) HDAC3HDAC11HDAC8HDAC6NPC1
SCHEMBL14113538 0.82 NPC1 (0.64) JAK3IDO1HDAC3HDAC11HDAC8
SCHEMBL3303017 0.82 NPC1 (0.64) JAK3IDO1HDAC3HDAC11HDAC8
Benzene SCHEMBL28977956 0.79 SMN1; SMN2 (0.70) HDAC3HDAC11HDAC8HDAC6NPC1
SCHEMBL57554 0.79 SMN1; SMN2 (0.70) HDAC3HDAC11HDAC8HDAC6NPC1
SCHEMBL3541484 0.79 NPC1 (0.53) JAK3IDO1HDAC3HDAC11HDAC8
SCHEMBL3541478 0.79 NPC1 (0.53) JAK3IDO1HDAC3HDAC11HDAC8
SCHEMBL3543079 0.79 HDAC8 (0.59) HDAC3HDAC11HDAC8HDAC6NPC1
SCHEMBL22618106 0.78 ATM (0.44) JAK3IDO1HDAC3HDAC11HDAC8
SCHEMBL29739410 0.78 ALDH1A1 (0.62) RAB9ATP53SMN1; SMN2MEN1GAA

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
EP-2203415-B1 (CYCLOPROPYL-PHENYL)-PHENYL-OXALAMIDES, METHOD FOR THEIR MANUFACTURE AND THEIR APPLICATION AS MEDICINES SANOFI SA (FR) 2016-10-26 EP disclosed
US-8148375-B2 (Cyclopropylphenyl)phenyloxamides, method for the production thereof, and use of same as a medicament SANOFI-AVENTIS (FR) 2012-04-03 US disclosed
US-8148375-B2 (Cyclopropylphenyl)phenyloxamides, method for the production thereof, and use of same as a medicament SANOFI-AVENTIS (FR) 2012-04-03 US disclosed
US-20100261644-A1 (CYCLOPROPYLPHENYL)PHENYLOXAMIDES, METHOD FOR THE PRODUCTION THEREOF, AND USE OF SAME AS A MEDICAMENT SANOFI-AVENTIS (FR) 2010-10-14 US disclosed
US-20100261644-A1 (CYCLOPROPYLPHENYL)PHENYLOXAMIDES, METHOD FOR THE PRODUCTION THEREOF, AND USE OF SAME AS A MEDICAMENT SANOFI-AVENTIS (FR) 2010-10-14 US disclosed
CN-101796018-A (cyclopropylphenyl) phenyloxamides, their production and their use as medicaments SANOFI AVENTIS 2010-08-04 CN disclosed
CN-101796018-A (cyclopropylphenyl) phenyloxamides, their production and their use as medicaments SANOFI AVENTIS 2010-08-04 CN disclosed
EP-2203415-A1 (CYCLOPROPYL-PHENYL)-PHENYL-OXALAMIDES, METHOD FOR THE PRODUCTION THEREOF, AND USE OF SAME AS A MEDICAMENT Sanofi-Aventis (FR) 2010-07-07 EP disclosed
EP-2203415-A1 (CYCLOPROPYL-PHENYL)-PHENYL-OXALAMIDES, METHOD FOR THE PRODUCTION THEREOF, AND USE OF SAME AS A MEDICAMENT Sanofi-Aventis (FR) 2010-07-07 EP disclosed
WO-2009039942-A1 (CYCLOPROPYL-PHENYL)-PHENYL-OXALAMIDES, METHOD FOR THE PRODUCTION THEREOF, AND USE OF SAME AS A MEDICAMENT SANOFI-AVENTIS (FR) 2009-04-02 WO disclosed
WO-2009039942-A1 (CYCLOPROPYL-PHENYL)-PHENYL-OXALAMIDES, METHOD FOR THE PRODUCTION THEREOF, AND USE OF SAME AS A MEDICAMENT SANOFI-AVENTIS (FR) 2009-04-02 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-20100261644-A1 (CYCLOPROPYLPHENYL)PHENYLOXAMIDES, METHOD FOR THE PRODUCTION THEREOF, AND USE OF SAME AS A MEDICAMENT PPOX, OAT, PNPO JAK3 2607/4885IDO1 416/4885HDAC3 2753/4885

“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.