SCHEMBL2525219

SCHEMBL2525219

O=C(NC1CCN(C(=O)CS)C(C(=O)O)C1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.49
PRMT6 Q96LA8 1/20 0.49
NPSR1 Q6W5P4 1/20 0.47
ADRA1D P25100 1/20 0.47
ADRA1A P35348 1/20 0.47
ADRA1B P35368 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
CTSK P43235 1/20 0.47
MCHR1 Q99705 3/20 0.46
POLB P06746 2/20 0.46
MMP2 P08253 1/20 0.46
ACE P12821 1/20 0.44
TMEM97 Q5BJF2 2/20 0.44
SIGMAR1 Q99720 2/20 0.44
SLC6A12 P48065 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44

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
SCHEMBL2399455 1.00 CARM1 (0.49) CARM1PRMT6NPSR1ADRA1DADRA1A
SCHEMBL2404529 0.89 CARM1 (0.50) CARM1PRMT6NPSR1ADRA1DADRA1A
SCHEMBL2400980 0.89 CARM1 (0.50) CARM1PRMT6NPSR1ADRA1DADRA1A
SCHEMBL3103440 0.89 MMP2 (0.56) CTSLCTSBCTSKMMP2ACE
SCHEMBL2401157 0.88 CARM1 (0.49) CARM1PRMT6NPSR1ADRA1DADRA1A
SCHEMBL2398822 0.88 CARM1 (0.49) CARM1PRMT6NPSR1ADRA1DADRA1A
SCHEMBL2399962 0.86 DPP4 (0.50) CARM1PRMT6NPSR1ADRA1DADRA1A
SCHEMBL2399957 0.86 DPP4 (0.50) CARM1PRMT6NPSR1ADRA1DADRA1A
SCHEMBL2400517 0.78 AGTR2 (0.49) CARM1PRMT6NPSR1ADRA1DADRA1A
SCHEMBL2525166 0.77 MMP2 (0.57) CARM1PRMT6CTSLCTSBCTSK

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-2386539-A2 Modified lysine-mimetic compounds Zealand Pharma A/S (DK) 2011-11-16 EP disclosed
US-D647202-S1 Bone marrow harvesting device WARSAW ORTHOPEDIC, INC. (US) 2011-10-18 US disclosed
EP-1966130-A2 MODIFIED LYSINE-MIMETIC COMPOUNDS Zealand Pharma A/S (DK) 2008-09-10 EP disclosed
WO-2007078990-A2 MODIFIED LYSINE-MIMETIC COMPOUNDS ZEALAND PHARMA A/S (DK) 2007-07-12 WO disclosed