SCHEMBL3828574

SCHEMBL3828574

COC(=O)C(N)Cc1cc2cc(OC)ccc2[nH]1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.58
MTNR1A P48039 3/20 0.57
MTNR1B P49286 2/20 0.57
PDGFRB P09619 2/20 0.51
PDGFRA P16234 2/20 0.51
KDM4E B2RXH2 5/20 0.51
ALDH1A1 P00352 4/20 0.51
NPC1 O15118 1/20 0.51
LMNA P02545 1/20 0.51
HPGD P15428 1/20 0.51
HTT P42858 1/20 0.51
RAB9A P51151 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MAPT P10636 2/20 0.48
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46
FLT3 P36888 4/20 0.46
PYGL P06737 1/20 0.46
CA2 P00918 1/20 0.46

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
SCHEMBL14173378 0.83 MTNR1A (0.50) LOXL2MTNR1AMTNR1BKDM4EALDH1A1
SCHEMBL15109307 0.83 MTNR1A (0.50) LOXL2MTNR1AMTNR1BKDM4EALDH1A1
SCHEMBL16756017 0.78 LOXL2 (0.63) LOXL2MTNR1AMTNR1BPDGFRBPDGFRA
SCHEMBL15902409 0.78 LOXL2 (0.67) LOXL2MTNR1AMTNR1BPDGFRBPDGFRA
SCHEMBL9679411 0.77 MTNR1A (0.64) LOXL2MTNR1AMTNR1BPDGFRBPDGFRA
SCHEMBL11623541 0.76 MTNR1A (0.62) LOXL2MTNR1AMTNR1BPDGFRBPDGFRA
SCHEMBL15224006 0.75 MTNR1A (0.65) LOXL2MTNR1AMTNR1BPDGFRBPDGFRA
SCHEMBL29390774 0.75 LOXL2 (0.63) LOXL2MTNR1AMTNR1BPDGFRBPDGFRA
SCHEMBL1331625 0.75 LOXL2 (0.63) LOXL2MTNR1AMTNR1BPDGFRBPDGFRA
SCHEMBL13091580 0.75 MTNR1A (0.61) LOXL2MTNR1AMTNR1BPDGFRBPDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2268640-B1 PROCESS FOR PREPARING ENANTIOMERICALLY PURE INDOLOPYRIDINES 4SC AG (DE) 2016-10-12 EP disclosed
EP-2098524-A1 Process for preparing enantiomerically pure indolopyrinidines 4SC AG (DE) 2009-09-09 EP disclosed