SCHEMBL7792268

SCHEMBL7792268

CCCOc1ccc2c(c1)C(=O)c1cccc(OCCCN(CC)CC)c1-2

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.58
KMT2A Q03164 2/20 0.58
CHRNA7 P36544 1/20 0.58
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
GAA P10253 1/20 0.45
RAB9A P51151 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KCNA3 P22001 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ESR1 P03372 1/20 0.44
XDH P47989 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
ALK Q9UM73 1/20 0.43
ADORA2A P29274 1/20 0.42
ADORA1 P30542 1/20 0.42

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
SCHEMBL27512821 0.98 MAPT (0.62) MAPTKMT2ACHRNA7MEN1NPC1
SCHEMBL7796272 0.97 MAPT (0.60) MAPTKMT2ACHRNA7MEN1NPC1
SCHEMBL7795949 0.97 MAPT (0.62) MAPTKMT2ACHRNA7MEN1NPC1
SCHEMBL7796349 0.94 MAPT (0.67) MAPTKMT2ACHRNA7ALKADORA2A
SCHEMBL7792632 0.92 MAPT (0.56) MAPTKMT2ACHRNA7ALDH1A1L3MBTL1
SCHEMBL7792554 0.92 MAPT (0.67) MAPTKMT2ACHRNA7MEN1NPC1
SCHEMBL7795961 0.92 MAPT (0.59) MAPTKMT2ACHRNA7KCNA3KDM4E
SCHEMBL7792614 0.91 MAPT (0.51) MAPTKMT2ACHRNA7MEN1NPC1
SCHEMBL7786287 0.91 MAPT (0.71) MAPTKMT2ACHRNA7ALKADORA2A
SCHEMBL7796240 0.90 MAPT (0.53) MAPTKMT2ACHRNA7ALDH1A1KCNA3

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-0906268-B1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS AVENTIS PHARMA INC (US) 2001-11-28 EP disclosed
US-6004959-A HYPOTENSIVE, ANTITUMOR, ANTIINFLAMMATORY AND ANTIASTHMATIC AGENTS; ANGIOGENESIS AND ALVEOLAR MACROPHAGE ACTIVATION INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US disclosed