SCHEMBL9634937

SCHEMBL9634937

NC1(Cc2ccccc2)CC(=O)N(Cc2ccccc2)C1=O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.47
CTSG P08311 2/20 0.46
F2 P00734 1/20 0.46
PLG P00747 1/20 0.46
CMA1 P23946 1/20 0.46
CTRC Q99895 1/20 0.46
GSK3A P49840 4/20 0.45
GSK3B P49841 4/20 0.45
PTGDR2 Q9Y5Y4 5/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
MGLL Q99685 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
POLB P06746 1/20 0.42
PRTN3 P24158 1/20 0.42

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
SCHEMBL8416125 0.78 ELANE (0.55) ELANECTSGF2PLGCMA1
SCHEMBL16397249 0.77 ELANE (0.53) ELANECTSGF2PLGCMA1
SCHEMBL16714701 0.76 ELANE (0.51) ELANECTSGF2PLGCMA1
SCHEMBL2257976 0.76 ELANE (0.61) ELANECTSGF2PLGCMA1
SCHEMBL2435976 0.76 ELANE (0.51) ELANECTSGF2PLGCMA1
SCHEMBL984328 0.75 CYP19A1 (0.52) ELANECTSGF2PLGCMA1
SCHEMBL7932603 0.73 ELANE (0.57) ELANECTSGF2PLGCMA1
SCHEMBL24126788 0.72 ELANE (0.56) ELANECTSGF2PLGCMA1
SCHEMBL9824381 0.72 ELANE (0.57) ELANECTSGF2PLGCMA1
SCHEMBL4002014 0.71 ELANE (0.53) ELANECTSGF2PLGCMA1

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
US-4910319-A Process for preparing 3-amino-1-benzylpyrrolidines BAYER AKTIENGESELLSCHAFT (DE) 1990-03-20 US claimed
EP-0310854-B1 PROCESS FOR THE MANUFACTURE OF 3-AMINO-1-BENZYL-PYRROLIDINES BAYER AG (DE) 1992-05-20 EP disclosed