SCHEMBL9513673

SCHEMBL9513673

CC(C)(N)C(=O)NC(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
HPGDS O60760 4/20 0.50
TSHR P16473 1/20 0.49
PRCP P42785 3/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 3/20 0.46
HPGD P15428 1/20 0.46
RIPK1 Q13546 1/20 0.44
CACNA2D1 P54289 1/20 0.44
CACNA1B Q00975 1/20 0.44
CACNB1 Q02641 1/20 0.44
CACNA1C Q13936 1/20 0.44
CYP3A4 P08684 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL14983903 0.85 KMT2A (0.61) LMNAHPGDSTSHRKMT2AMEN1
SCHEMBL14646356 0.85 LMNA (0.51) LMNAHPGDSTSHRKMT2AMEN1
SCHEMBL12310855 0.84 PRCP (0.56) LMNAPRCPKMT2AMEN1ALDH1A1
SCHEMBL4426855 0.81 LMNA (0.49) LMNAHPGDSTSHRKMT2AMEN1
SCHEMBL12863553 0.79 RIPK1 (0.69) LMNAHPGDSTSHRKMT2AMEN1
SCHEMBL8358267 0.77 HPGDS (0.49) LMNAHPGDSTSHRKMT2AMEN1
SCHEMBL7317251 0.75 LMNA (0.50) LMNAHPGDSTSHRKMT2AMEN1
SCHEMBL7317247 0.75 LMNA (0.50) LMNAHPGDSTSHRKMT2AMEN1
SCHEMBL425361 0.74 ALDH1A1 (0.58) LMNAHPGDSTSHRKMT2AMEN1
SCHEMBL1386996 0.74 LMNA (0.79) LMNAHPGDSTSHRKMT2AMEN1

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-0333938-B1 2-HYDROXY-3-ARYLOXY-PROPYLAMINE DERIVATIVES HAVING CARDIOVASCULAR ACTIVITY ZAMBON GROUP S.p.A. (IT) 1993-04-14 EP disclosed
US-5047425-A Amine derivatives having cardiovascular activity SIMES SOCIETA ITALIANA MEDICINALI & SINTETICI SPA (IT) 1991-09-10 US disclosed
EP-0333938-A1 2-Hydroxy-3-aryloxy-propylamine derivatives having cardiovascular activity ZAMBON GROUP S.p.A. (IT) 1989-09-27 EP disclosed