SCHEMBL7906190

SCHEMBL7906190

COc1ccc(C(O)CN)c(OCCCCCc2ccccc2)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.49
ADRA1A P35348 1/20 0.49
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PDE4A P27815 3/20 0.47
PDE4B Q07343 3/20 0.47
PDE4C Q08493 3/20 0.47
PDE4D Q08499 3/20 0.47
F2 P00734 1/20 0.46
ELANE P08246 1/20 0.46
MTNR1B P49286 2/20 0.45
CYP11B1 P15538 2/20 0.45
CYP11B2 P19099 2/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
MTNR1A P48039 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
SCHEMBL7906188 0.79 PDE4B (0.56) PDE4APDE4BPDE4CPDE4D
SCHEMBL7153263 0.76 ADRA1A (0.75) ADRA2AADRA1AMEN1KMT2A
SCHEMBL12040566 0.69 TDP1 (0.75) TDP1L3MBTL1
SCHEMBL5966301 0.69 TDP1 (0.75) TDP1L3MBTL1
SCHEMBL1172674 0.69 SLC2A1 (0.61) TDP1L3MBTL1
Hydrochloric Acid SCHEMBL5663603 0.69 HTR2A (0.61)
SCHEMBL7919811 0.69 NFKB1 (0.55)
SCHEMBL1172476 0.69 TDP1 (0.69) TDP1L3MBTL1MEN1KMT2A
SCHEMBL7144089 0.69 ADRA2A (0.50) ADRA2AADRA1ATDP1MEN1KMT2A
SCHEMBL1171680 0.69 TDP1 (0.69) TDP1L3MBTL1MEN1KMT2A

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
US-6265402-B1 ANTIINFLAMMATORY AGENTS NIKKEN CHEMICALS CO., LTD. (JP) 2001-07-24 US disclosed
EP-0924204-A1 2-PHENYLMORPHOLIN-5-ONE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Nikken Chemicals Company, Limited (JP) 1999-06-23 EP disclosed