SCHEMBL7794712

SCHEMBL7794712

O=C1c2ccc(OCCCCC3CCNC3)cc2-c2c(OCCCCC3CCNC3)cccc21

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.47
ITGB3 P05106 13/20 0.44
ITGA2B P08514 13/20 0.44
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
NPY1R P25929 2/20 0.37
TERT O14746 1/20 0.36

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
SCHEMBL7794745 0.97 KCNA3 (0.46) KCNA3ITGB3ITGA2BSLC6A2SLC6A4
SCHEMBL7786473 0.94 ITGB3 (0.50) KCNA3ITGB3ITGA2BSLC6A4TERT
SCHEMBL7792589 0.91 KCNA3 (0.44) KCNA3ITGB3ITGA2BNPY1R
SCHEMBL7796400 0.89 MAPT (0.42) KCNA3ITGB3ITGA2BSLC6A2SLC6A4
SCHEMBL7792411 0.88 HTR2A (0.41) KCNA3ITGB3ITGA2BSLC6A2SLC6A4
SCHEMBL7791994 0.87 TTR (0.40) KCNA3ITGB3ITGA2BSLC6A2SLC6A4
SCHEMBL7792388 0.86 ACP1 (0.41) KCNA3ITGB3ITGA2BSLC6A2SLC6A4
SCHEMBL7796437 0.86 KCNA3 (0.48) KCNA3ITGB3ITGA2BNPY1RTERT
SCHEMBL7792449 0.84 KCNA3 (0.41) KCNA3ITGB3ITGA2BSLC6A4NPY1R
SCHEMBL7794705 0.84 NPY1R (0.41) KCNA3NPY1R

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