SCHEMBL7916072

SCHEMBL7916072

COc1ccc(C(O)CN)cc1OCC1CCCC1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 8/20 0.57
NFKB1 P19838 1/20 0.55
BLM P54132 1/20 0.53
PMP22 Q01453 1/20 0.53
PARP15 Q460N3 1/20 0.47
PARP10 Q53GL7 1/20 0.47
PDE4A P27815 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
ADRA2A P08913 1/20 0.43
ADRA1A P35348 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
SCHEMBL7916056 0.97 PDE4B (0.57) PDE4BNFKB1BLMPMP22PARP15
SCHEMBL30352570 0.95 PDE4B (0.63) PDE4BNFKB1BLMPMP22PDE4A
SCHEMBL7913450 0.95 PDE4B (0.63) PDE4BNFKB1BLMPMP22PDE4A
SCHEMBL6582595 0.85 PDE4B (0.55) PDE4BPARP15PARP10PDE4APDE4C
SCHEMBL6585923 0.82 PDE4B (0.55) PDE4BPDE4APDE4CPDE4D
SCHEMBL7913418 0.82 PDE4A (0.59) PDE4BNFKB1BLMPMP22PDE4A
SCHEMBL7915754 0.81 PDE4A (0.58) PDE4BNFKB1BLMPMP22PDE4A
SCHEMBL15921910 0.80 NFKB1 (0.75) NFKB1BLMPMP22ADRA2AADRA1A
SCHEMBL29633151 0.80 NFKB1 (0.75) NFKB1BLMPMP22ADRA2AADRA1A
SCHEMBL1966507 0.80 NFKB1 (0.75) NFKB1BLMPMP22ADRA2AADRA1A

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