SCHEMBL5718006

SCHEMBL5718006

CC(C)Nc1cccc(COc2c(Cl)cc(CC(=O)OC(=O)CNC(=O)c3cc(Cl)c(OCc4cccc(NC(C)C)c4)c(Cl)c3)cc2Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PLAU P00749 2/20 0.40
MRGPRX4 Q96LA9 7/20 0.39
KMT2A Q03164 3/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
MEN1 O00255 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PKM P14618 1/20 0.37
SENP5 Q96HI0 1/20 0.36
SENP2 Q9HC62 1/20 0.36
SENP1 Q9P0U3 1/20 0.36
LMNA P02545 1/20 0.36
GLA P06280 1/20 0.36
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL5722571 0.91 SENP5 (0.44) PLAUMRGPRX4KMT2ANPC1RAB9A
SCHEMBL5717977 0.90 MRGPRX4 (0.42) PLAUMRGPRX4KMT2ANPC1RAB9A
SCHEMBL5722619 0.90 SENP5 (0.46) PLAUMRGPRX4KMT2ANPC1RAB9A
SCHEMBL5717924 0.89 LMNA (0.37) PLAUMRGPRX4KMT2ANPC1RAB9A
SCHEMBL5722819 0.88 SENP5 (0.46) PLAUMRGPRX4KMT2ANPC1RAB9A
SCHEMBL5717999 0.88 NPC1 (0.41) PLAUMRGPRX4KMT2ANPC1RAB9A
SCHEMBL5717818 0.88 HSD17B10 (0.35) PLAUMRGPRX4KMT2ANPC1RAB9A
SCHEMBL5718130 0.87 MRGPRX4 (0.41) MRGPRX4KMT2ANPC1RAB9AMEN1
SCHEMBL5717907 0.87 MAPT (0.35) PLAUMRGPRX4KMT2AMEN1MAPT
SCHEMBL4924596 0.86 RAB9A (0.45) PLAUMRGPRX4KMT2ANPC1RAB9A

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-1732533-A1 THYROID RECEPTOR AGONISTS KARO BIO AB (SE) 2006-12-20 EP disclosed
WO-2005092317-A1 THYROID RECEPTOR AGONISTS KARO BIO AB (SE) 2005-10-06 WO disclosed