SCHEMBL15949299

SCHEMBL15949299

CCOc1ccc(C(=O)N2CC(N3CCN(C(=O)c4ccccc4)CC3)C2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.64
▸ HSD17B10 Q99714 1/20 0.64
▸ KDM4E B2RXH2 4/20 0.63
▸ LMNA P02545 3/20 0.63
▸ PKM P14618 2/20 0.63
▸ MAPK1 P28482 1/20 0.63
▸ SMN1; SMN2 Q16637 1/20 0.63
▸ HPGD P15428 3/20 0.61
▸ L3MBTL1 Q9Y468 1/20 0.61
▸ GAA P10253 1/20 0.61
▸ NPC1 O15118 1/20 0.55
▸ MAPT P10636 3/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ HTT P42858 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54
▸ RECQL P46063 1/20 0.52
▸ POLB P06746 1/20 0.51
▸ KCNA5 P22460 1/20 0.51

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
SCHEMBL15949477 0.87 SLC6A7 (0.63) ALDH1A1KDM4ELMNAPKMMAPK1
SCHEMBL15949260 0.85 MGLL (0.67) ALDH1A1KDM4ELMNASMN1; SMN2L3MBTL1
SCHEMBL693780 0.84 KMT2A (0.56) ALDH1A1KDM4EL3MBTL1MEN1KMT2A
SCHEMBL15949350 0.83 KDM4E (0.60) ALDH1A1HSD17B10KDM4ELMNAMAPK1
SCHEMBL15949189 0.83 TP53 (0.52) ALDH1A1KDM4ELMNAHPGDL3MBTL1
SCHEMBL911234 0.82 ALDH1A1 (0.65) ALDH1A1KDM4ELMNAPKMMAPK1
SCHEMBL14878216 0.82 MGLL (0.46) ALDH1A1KDM4ELMNAPKMMAPK1
SCHEMBL912523 0.82 SLC6A7 (0.60) ALDH1A1KDM4ELMNAMAPK1SMN1; SMN2
SCHEMBL912218 0.82 MGLL (0.56) ALDH1A1KDM4EHPGDNPC1MAPT
SCHEMBL912776 0.81 SLC6A7 (0.57) ALDH1A1KDM4ELMNASMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2421823-B1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2015-01-14 — — EP disclosed
EP-2421825-B9 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2014-08-20 — — EP disclosed
EP-2421825-B1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2014-01-01 — — EP disclosed
Send feedback