SCHEMBL7795912

SCHEMBL7795912

CCOc1ccc2c(c1)C(=O)c1cccc(OCCN(CC)CC)c1-2

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.64
KMT2A Q03164 2/20 0.64
CHRNA7 P36544 1/20 0.64
TTR P02766 1/20 0.46
ALK Q9UM73 1/20 0.46
ADORA2A P29274 2/20 0.46
ADORA1 P30542 2/20 0.46
POLB P06746 1/20 0.44
HTT P42858 1/20 0.44
SMARCA2 P51531 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL7786287 0.95 MAPT (0.71) MAPTKMT2ACHRNA7ALKADORA2A
SCHEMBL7792632 0.94 MAPT (0.56) MAPTKMT2ACHRNA7TTRL3MBTL1
SCHEMBL7792554 0.92 MAPT (0.67) MAPTKMT2ACHRNA7ADORA2AADORA1
SCHEMBL7796349 0.92 MAPT (0.67) MAPTKMT2ACHRNA7ALKADORA2A
SCHEMBL7786303 0.91 MAPT (0.61) MAPTKMT2ACHRNA7ALKADORA2A
SCHEMBL7792326 0.91 MAPT (0.67) MAPTKMT2ACHRNA7ADORA2AADORA1
SCHEMBL7795949 0.89 MAPT (0.62) MAPTKMT2ACHRNA7ADORA2AADORA1
SCHEMBL27512821 0.89 MAPT (0.62) MAPTKMT2ACHRNA7ALKADORA2A
SCHEMBL28742032 0.88 MAPT (0.57) MAPTKMT2ACHRNA7ALK
SCHEMBL7796272 0.87 MAPT (0.60) MAPTKMT2ACHRNA7ADORA2AADORA1

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