SCHEMBL8567390

SCHEMBL8567390

COC(C)OCC1Cc2ccccc2N(C(=O)OC(C)(C)C)C1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.40
MTNR1A P48039 4/20 0.39
MTNR1B P49286 4/20 0.39
KDM1A O60341 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
BCHE P06276 1/20 0.36
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
NR1I3 Q14994 1/20 0.35
NOTUM Q6P988 1/20 0.34
PRKCG P05129 1/20 0.34
PRKCA P17252 1/20 0.34
PRKCD Q05655 1/20 0.34

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
SCHEMBL8567399 1.00 NAMPT (0.40) NAMPTMTNR1AMTNR1BKDM1AHDAC1
SCHEMBL16384801 0.82 NAMPT (0.43) NAMPTMTNR1AMTNR1BKDM1AHDAC1
SCHEMBL8567394 0.81 NAMPT (0.41) NAMPTMTNR1AMTNR1BKDM1AHDAC1
SCHEMBL8567303 0.81 NAMPT (0.46) NAMPTMTNR1AMTNR1BKDM1AHDAC1
SCHEMBL8567306 0.81 NAMPT (0.46) NAMPTMTNR1AMTNR1BKDM1AHDAC1
SCHEMBL16385106 0.81 NAMPT (0.46) NAMPTMTNR1AMTNR1BKDM1AHDAC1
SCHEMBL8567308 0.81 NAMPT (0.46) NAMPTMTNR1AMTNR1BKDM1AHDAC1
SCHEMBL16353469 0.81 NAMPT (0.42) NAMPTMTNR1AMTNR1BKDM1AHDAC1
SCHEMBL16353534 0.81 NAMPT (0.42) NAMPTMTNR1AMTNR1BKDM1AHDAC1
SCHEMBL6410947 0.80 NAMPT (0.46) NAMPTMTNR1AMTNR1BKDM1AHDAC1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5719141-A HYPOTENSIVE AGENTS NOVARTIS CORPORATION (US) 1998-02-17 US disclosed