SCHEMBL7792632

SCHEMBL7792632

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

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.56
CHRNA7 P36544 1/20 0.56
KMT2A Q03164 1/20 0.56
TTR P02766 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
KCNA3 P22001 1/20 0.43
ESR1 P03372 1/20 0.43
ALDH1A1 P00352 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
XDH P47989 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
SCHEMBL7795949 0.95 MAPT (0.62) MAPTCHRNA7KMT2AL3MBTL1KCNA3
SCHEMBL7795912 0.94 MAPT (0.64) MAPTCHRNA7KMT2ATTRL3MBTL1
SCHEMBL7796272 0.93 MAPT (0.60) MAPTCHRNA7KMT2AL3MBTL1KCNA3
SCHEMBL7792268 0.92 MAPT (0.58) MAPTCHRNA7KMT2AL3MBTL1KCNA3
SCHEMBL7796240 0.91 MAPT (0.53) MAPTCHRNA7KMT2AKCNA3ESR1
SCHEMBL7795961 0.91 MAPT (0.59) MAPTCHRNA7KMT2AKCNA3KDM4E
SCHEMBL27512821 0.90 MAPT (0.62) MAPTCHRNA7KMT2AL3MBTL1ALDH1A1
SCHEMBL7786287 0.90 MAPT (0.71) MAPTCHRNA7KMT2A
SCHEMBL27494400 0.89 MAPT (0.46) MAPTCHRNA7KMT2AALDH1A1KDM4E
SCHEMBL28742032 0.89 MAPT (0.57) MAPTCHRNA7KMT2AKCNA3ESR1

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