SCHEMBL926630

SCHEMBL926630

CCOC(=O)c1cc2cc([Si](C)(C)C)ccc2n1Cc1cccc(C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD2 Q9HC29 1/20 0.56
NOD1 Q9Y239 1/20 0.56
F10 P00742 6/20 0.54
MAPT P10636 6/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
THRB P10828 2/20 0.51
ALDH1A1 P00352 5/20 0.47
HPGD P15428 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
POLB P06746 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
TSHR P16473 1/20 0.47
ATM Q13315 1/20 0.47
KDM4E B2RXH2 3/20 0.46
ECE1 P42892 1/20 0.44
TP53 P04637 1/20 0.44
F2 P00734 1/20 0.43
CCR2 P41597 1/20 0.43

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
SCHEMBL927446 0.92 NOD2 (0.56) NOD2NOD1F10MAPTSMN1; SMN2
SCHEMBL939884 0.90 F10 (0.52) NOD2NOD1F10MAPTALDH1A1
SCHEMBL12930104 0.89 NOD2 (0.67) NOD2NOD1F10MAPTSMN1; SMN2
SCHEMBL925921 0.88 F10 (0.51) NOD2NOD1F10MAPTSMN1; SMN2
SCHEMBL3664017 0.87 CCR2 (0.55) F10MAPTSMN1; SMN2THRBECE1
SCHEMBL3201430 0.86 NOD2 (0.63) NOD2NOD1F10MAPTSMN1; SMN2
SCHEMBL1051950 0.85 NOD2 (0.56) NOD2NOD1F10MAPTSMN1; SMN2
SCHEMBL1054163 0.84 NOD2 (0.55) NOD2NOD1F10MAPTSMN1; SMN2
SCHEMBL12930101 0.82 NOD2 (0.67) NOD2NOD1F10MAPTSMN1; SMN2
SCHEMBL15304632 0.81 NOD2 (0.54) NOD2NOD1F10MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2235015-B1 AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2016-08-24 EP disclosed
US-8604050-B2 Bicyclic derivatives of azabicyclic carboxamides, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-12-10 US disclosed
US-8354425-B2 Azabicyclic carboxamide derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-01-15 US disclosed
US-8354425-B2 Azabicyclic carboxamide derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-01-15 US disclosed
US-8299114-B2 Bicyclic derivatives of azabicyclic carboxamides, preparation thereof and therapeutic use thereof SANOFI (FR) 2012-10-30 US disclosed
US-20120252837-A1 BICYCLIC DERIVATIVES OF AZABICYCLIC CARBOXAMIDES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-10-04 US disclosed
US-20110009400-A1 BICYCLIC DERIVATIVES OF AZABICYCLIC CARBOXAMIDES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-01-13 US disclosed
US-20110009364-A1 AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-01-13 US disclosed
US-20110009364-A1 AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-01-13 US disclosed
WO-2009112678-A2 AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-09-17 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 (3 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-20110009400-A1 BICYCLIC DERIVATIVES OF AZABICYCLIC CARBOXAMIDES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF XDH, NQO2, HDAC1 NOD2 703/4885NOD1 228/4885F10 1624/4885
US-20110009364-A1 AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF ZYX, XDH, ZFX NOD2 1676/4885NOD1 269/4885F10 1361/4885
US-20120252837-A1 BICYCLIC DERIVATIVES OF AZABICYCLIC CARBOXAMIDES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF XDH, NQO2, HDAC1 NOD2 703/4885NOD1 228/4885F10 1624/4885

“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.