SCHEMBL7791786

SCHEMBL7791786

CCN(CC)CCOc1cccc2c1C(=O)c1cccc(OCCN(CC)CC)c1-2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.50
MAOB P27338 1/20 0.49
MAPT P10636 2/20 0.48
KMT2A Q03164 2/20 0.48
CHRNA7 P36544 1/20 0.48
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 1/20 0.47
LMNA P02545 1/20 0.47
DRD2 P14416 1/20 0.47
DRD1 P21728 1/20 0.47
DRD3 P35462 1/20 0.47
TERT O14746 2/20 0.46
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
TTR P02766 1/20 0.43
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
DNMT1 P26358 1/20 0.42
RAD52 P43351 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
SCHEMBL8380843 0.96 TTR (0.49) KCNA3MAOBMAPTKMT2ACHRNA7
SCHEMBL8380922 0.95 EGFR (0.49) KCNA3MAOBMAPTKMT2ACHRNA7
SCHEMBL11604524 0.93 KCNA3 (0.59) KCNA3MAOBMAPTKMT2ACHRNA7
SCHEMBL7795728 0.93 KCNA3 (0.52) KCNA3MAOBALDH1A1KDM4ETERT
Hydrochloric Acid SCHEMBL11604026 0.92 KCNA3 (0.58) KCNA3MAOBMAPTKMT2ACHRNA7
SCHEMBL7786104 0.92 KCNA3 (0.55) KCNA3MAOBMAPTKMT2AALDH1A1
SCHEMBL5745370 0.90 KCNA3 (0.52) KCNA3MAOBMAPTKMT2ACHRNA7
SCHEMBL8382501 0.89 KCNA3 (0.49) KCNA3MAOBALDH1A1KDM4ETERT
SCHEMBL7792639 0.87 MAPT (0.50) KCNA3MAOBMAPTKMT2ACHRNA7
SCHEMBL7796277 0.87 MAPT (0.50) KCNA3MAOBMAPTKMT2ACHRNA7

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 4 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
EP-0906268-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-04-07 EP disclosed
WO-1997045397-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1997-12-04 WO disclosed