SCHEMBL7786391

SCHEMBL7786391

CCCOc1cc(OCCCC2CCNC2)cc2c1-c1c(OCCCC3CCNC3)cccc1C2=O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
KCNA3 P22001 1/20 0.41
ELANE P08246 4/20 0.37
ITGB3 P05106 2/20 0.36
ITGA2B P08514 2/20 0.36
NPY1R P25929 6/20 0.36
MDM2 Q00987 1/20 0.34

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
SCHEMBL7786238 1.00 HTR2A (0.42) HTR2AHTR2CHTR2BKCNA3ELANE
SCHEMBL7792449 0.96 KCNA3 (0.41) HTR2AHTR2CHTR2BKCNA3ELANE
SCHEMBL7794815 0.94 HTR2A (0.41) HTR2AHTR2CHTR2BKCNA3ELANE
SCHEMBL7786481 0.94 HTR2A (0.41) HTR2AHTR2CHTR2BKCNA3ELANE
SCHEMBL7794782 0.94 KCNA3 (0.41) HTR2AHTR2CHTR2BKCNA3ITGB3
SCHEMBL7786173 0.92 HTR2A (0.39) HTR2AHTR2CHTR2BKCNA3ITGB3
SCHEMBL7792363 0.92 HTR2A (0.47) HTR2AHTR2CHTR2BKCNA3ELANE
SCHEMBL7786255 0.91 KCNA3 (0.41) HTR2AHTR2CHTR2BKCNA3ITGB3
SCHEMBL7795714 0.90 NPY1R (0.42) KCNA3NPY1R
SCHEMBL7792411 0.90 HTR2A (0.41) HTR2AHTR2CHTR2BKCNA3ITGB3

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