SCHEMBL6919302

SCHEMBL6919302

NC(=O)OC(Cn1cccn1)c1ccc(N)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
FDPS P14324 1/20 0.39
NLRP3 Q96P20 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
CYP19A1 P11511 1/20 0.35
THRB P10828 1/20 0.34
HTT P42858 1/20 0.34
MAP2K1 Q02750 1/20 0.34
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33

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
SCHEMBL6923835 0.84 TSHR (0.39) TSHRFDPSNLRP3SMN1; SMN2CYP19A1
SCHEMBL30595455 0.72 FDPS (0.45) TSHRFDPSNLRP3TDP1HDAC1
SCHEMBL4307811 0.71 ADRB1 (0.44)
SCHEMBL6679211 0.69 PTPRA (0.46) FDPSSMN1; SMN2
SCHEMBL7789025 0.69 KMT2A (0.48) POLBHTT
SCHEMBL4304627 0.69 HMOX1 (0.43) SMN1; SMN2CYP19A1
SCHEMBL4310334 0.69 PTGS2 (0.39) CYP19A1
SCHEMBL13667412 0.69 CYP1A2 (0.38) TSHRTHRB
SCHEMBL4308663 0.69 ADRB1 (0.36)
SCHEMBL4321687 0.69 CYP1A2 (0.38) TSHRTHRB

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
WO-2004039795-A2 AMIDE COMPOUNDS FOR THE TREATMENT OF HYPERLIPIDEMIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-13 WO disclosed