SCHEMBL1669460

SCHEMBL1669460

N#Cc1ccc(CNC(=O)N2CCN(C(=O)O)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.55
▸ FAAH O00519 1/20 0.53
▸ KMT2A Q03164 3/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ TPSAB1 Q15661 2/20 0.50
▸ KIT P10721 1/20 0.49
▸ SLC1A3 P43003 1/20 0.48
▸ SLC1A2 P43004 1/20 0.48
▸ HRH3 Q9Y5N1 3/20 0.48
▸ TP53 P04637 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ PKM P14618 1/20 0.46
▸ TPSD1 Q9BZJ3 1/20 0.46
▸ TPSG1 Q9NRR2 1/20 0.46
▸ SCN5A Q14524 1/20 0.46
▸ SCN9A Q15858 1/20 0.46
▸ EPHX2 P34913 1/20 0.46
▸ F2 P00734 1/20 0.45
▸ PRSS1 P07477 1/20 0.45
▸ CHRM4 P08173 1/20 0.45

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
SCHEMBL1668842 0.86 KIT (0.49) KDM4EFAAHKMT2AMEN1TPSAB1
SCHEMBL11903553 0.85 RAB9A (0.51) KDM4EFAAHKMT2AMEN1TPSAB1
SCHEMBL12685798 0.84 FAAH (0.72) KDM4EFAAHKMT2ATPSAB1CHRM4
SCHEMBL7448516 0.84 TPSAB1 (0.62) KDM4EKMT2AMEN1TPSAB1HRH3
SCHEMBL1668815 0.81 SMN1; SMN2 (0.52) KDM4EKMT2AMEN1TPSAB1NPSR1
SCHEMBL12685865 0.80 MEN1 (0.79) KDM4EFAAHKMT2AMEN1HRH3
SCHEMBL31298082 0.80 NPC1 (0.58) KDM4EFAAHKMT2AMEN1TP53
SCHEMBL7958872 0.78 TPSAB1 (0.54) KDM4EKMT2AMEN1TPSAB1HRH3
SCHEMBL1068618 0.78 FAAH (0.67) FAAHKMT2AMEN1
SCHEMBL7502026 0.78 CNR1 (0.58) FAAH

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-2485678-A1 COFERONS AND METHODS OF MAKING AND USING THEM Cornell University (US) 2012-08-15 — — EP disclosed
WO-2011043817-A1 COFERONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2011-04-14 — — WO disclosed
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