SCHEMBL6589364

SCHEMBL6589364

CC(C)(C)OC(=O)c1ccc(CN(CC(=O)O)C2CCCCC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.43
▸ KMT2A Q03164 6/20 0.43
▸ GPR119 Q8TDV5 1/20 0.39
▸ AGER Q15109 3/20 0.39
▸ MTNR1A P48039 1/20 0.39
▸ PPARD Q03181 1/20 0.38
▸ MAPK1 P28482 2/20 0.37
▸ SIRT2 Q8IXJ6 1/20 0.37
▸ SIRT1 Q96EB6 1/20 0.37
▸ JAK2 O60674 1/20 0.37
▸ JAK1 P23458 1/20 0.37
▸ POLB P06746 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL6588636 0.88 MEN1 (0.47) MEN1KMT2AGPR119PPARDMAPK1
SCHEMBL27398768 0.82 KMT2A (0.43) MEN1KMT2APPARDMAPK1POLB
SCHEMBL6587329 0.81 AGER (0.45) MEN1KMT2AGPR119AGERMTNR1A
SCHEMBL27398613 0.77 MEN1 (0.42) MEN1KMT2AAGERMTNR1APPARD
SCHEMBL27403757 0.74 MEN1 (0.40) MEN1KMT2APPARDMAPK1SMN1; SMN2
SCHEMBL2401141 0.74 MEN1 (0.46) MEN1KMT2AAGERMTNR1AMAPK1
SCHEMBL6589334 0.74 GPR119 (0.39) KMT2AGPR119SIRT2SIRT1JAK2
SCHEMBL3117999 0.73 AGER (0.48) MEN1KMT2AGPR119AGERMTNR1A
SCHEMBL6587980 0.73 HTR2C (0.38) MEN1KMT2AGPR119SIRT2SIRT1
SCHEMBL27780875 0.72 BTK (0.35) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1169338-B1 LOW-MOLECULAR INHIBITORS OF COMPLEMENT PROTEASES ABBOTT GMBH & CO KG (DE) 2004-11-03 — — EP disclosed
US-6683055-B1 GUANIDINE OR AMIDINE TERMINED PEPTIDES BASF AKTIENGESELLSCHAFT (DE) 2004-01-27 — — US disclosed
EP-1169338-A2 LOW-MOLECULAR INHIBITORS OF COMPLEMENT PROTEASES BASF AKTIENGESELLSCHAFT (DE) 2002-01-09 — — EP disclosed
WO-2000061608-A2 LOW-MOLECULAR INHIBITORS OF COMPLEMENT PROTEASES BASF AKTIENGESELLSCHAFT (DE) 2000-10-19 — — WO disclosed
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