SCHEMBL8540533

SCHEMBL8540533

O=C(c1ccc(-c2ccc(Cl)cc2)cc1)N1CC1c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EIF4A3 P38919 12/20 0.53
MGLL Q99685 3/20 0.51
SLC6A7 Q99884 2/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
FFAR2 O15552 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
SCHEMBL8540536 1.00 EIF4A3 (0.53) EIF4A3MGLLSLC6A7MEN1KMT2A
SCHEMBL7067642 0.95 EIF4A3 (0.53) EIF4A3MGLLMEN1KMT2A
SCHEMBL7133590 0.84 RIPK1 (0.54) MEN1KMT2A
SCHEMBL4657697 0.71 RIPK1 (0.47) MEN1KMT2A
SCHEMBL4657693 0.71 RIPK1 (0.47) MEN1KMT2A
SCHEMBL15949390 0.71 HPGD (0.48) EIF4A3MGLLSLC6A7MEN1KMT2A
SCHEMBL911549 0.71 HPGD (0.48) EIF4A3MGLLSLC6A7MEN1KMT2A
SCHEMBL3888129 0.71 SLC6A7 (0.57) MGLLSLC6A7MEN1KMT2A
SCHEMBL15949277 0.70 MGLL (0.60) MGLLSLC6A7MEN1KMT2A
SCHEMBL14540882 0.69 CA1 (0.81) MEN1KMT2A

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-0683156-B1 Acylated aminoalkanimidazoles and -triazoles CIBA GEIGY AG (CH) 1998-04-01 EP disclosed
US-5622982-A ENZYME INHIBITORS; ANTIINFLAMMATORY AGENTS SANDOZ LTD. (CH) 1997-04-22 US disclosed
EP-0683156-A1 Acylated aminoalkanimidazoles and -triazoles SANDOZ LTD. (CH) 1995-11-22 EP disclosed