SCHEMBL4379822

SCHEMBL4379822

CCCCCCCCCC1(CC)C(=O)NC(=O)NC1=O

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 10/20 0.63
MMP2 P08253 9/20 0.63
MMP8 P22894 7/20 0.63
MMP13 P45452 7/20 0.63
LMNA P02545 2/20 0.61
MMP3 P08254 2/20 0.51
ALDH1A1 P00352 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 1/20 0.39
CYP3A4 P08684 1/20 0.39
GABRB3 P28472 1/20 0.39
OPRD1 P41143 1/20 0.39
GABRA2 P47869 1/20 0.39
GABRB2 P47870 1/20 0.39

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
SCHEMBL712742 1.00 MMP9 (0.63) MMP9MMP2MMP8MMP13LMNA
SCHEMBL4390355 1.00 MMP9 (0.63) MMP9MMP2MMP8MMP13LMNA
SCHEMBL4382583 1.00 MMP9 (0.63) MMP9MMP2MMP8MMP13LMNA
SCHEMBL1641551 0.98 MMP9 (0.61) MMP9MMP2MMP8MMP13LMNA
SCHEMBL918796 0.98 LMNA (0.64) MMP9MMP2MMP8MMP13LMNA
SCHEMBL5450754 0.92 MMP9 (0.67) MMP9MMP2MMP8MMP13LMNA
SCHEMBL468545 0.92 MMP9 (0.67) MMP9MMP2MMP8MMP13LMNA
Butethal SCHEMBL44262 0.92 LMNA (0.67) MMP9MMP2MMP8MMP13LMNA
Butethal SCHEMBL2718536 0.90 LMNA (0.64) MMP9MMP2MMP8MMP13LMNA
SCHEMBL14788924 0.85 LMNA (0.57) MMP9MMP2MMP8MMP13LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9918934-B2 Linker-based lecithin microemulsion delivery vehicles ACOSTA ZARA EDGAR JOEL (CA) 2018-03-20 US disclosed
EP-2120871-B2 LINKER-BASED LECITHIN MICROEMULSION DELIVERY VEHICLES ACOSTA-ZARA EDGAR JOEL (CA) 2017-12-20 EP disclosed
EP-2120871-B1 LINKER-BASED LECITHIN MICROEMULSION DELIVERY VEHICLES ACOSTA-ZARA EDGAR JOEL (CA) 2014-11-26 EP disclosed
CN-101636148-B Linker-based lecithin microemulsion delivery vehicle ACOSTA-ZARA EDGAR JOEL 2014-02-26 CN disclosed
CN-101636148-A Linker-based lecithin microemulsion delivery vehicle JOEL ACOSTA-ZARA EDGAR 2010-01-27 CN disclosed
EP-2120871-A1 LINKER-BASED LECITHIN MICROEMULSION DELIVERY VEHICLES Acosta-Zara, Edgar, Joel (CA) 2009-11-25 EP disclosed
WO-2008070961-A1 LINKER-BASED LECITHIN MICROEMULSION DELIVERY VEHICLES ACOSTA-ZARA EDGAR JOEL (CA) 2008-06-19 WO disclosed
US-20080139392-A1 Linker-Based Lecithin Microemulsion Delivery Vehicles ACOSTA-ZARA EDGAR JOEL 2008-06-12 US disclosed
US-20080104001-A1 ALGORITHM FOR ESTIMATION OF BINDING EQULIBRIA IN INCLUSION COMPLEXATION, HOST COMPOUNDS IDENTIFIED THEREBY AND COMPOSITIONS OF HOST COMPOUND AND PHARMACEUTICAL BAXTER INTERNATIONAL INC. 2008-05-01 US disclosed