SCHEMBL7792449

SCHEMBL7792449

CCCCOc1cc(OCCCC2CCNC2)cc2c1-c1c(OCCCC3CCNC3)cccc1C2=O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.41
ELANE P08246 3/20 0.38
ITGB3 P05106 6/20 0.38
ITGA2B P08514 6/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
NPY1R P25929 5/20 0.37
ITGAV P06756 1/20 0.36
CHRM2 P08172 1/20 0.36
SLC6A4 P31645 1/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL7786238 0.96 HTR2A (0.42) KCNA3ELANEITGB3ITGA2BHTR2A
SCHEMBL7786391 0.96 HTR2A (0.42) KCNA3ELANEITGB3ITGA2BHTR2A
SCHEMBL7795714 0.94 NPY1R (0.42) KCNA3NPY1R
SCHEMBL7794782 0.94 KCNA3 (0.41) KCNA3ITGB3ITGA2BHTR2AHTR2C
SCHEMBL7786173 0.92 HTR2A (0.39) KCNA3ITGB3ITGA2BHTR2AHTR2C
SCHEMBL7791763 0.92 ELANE (0.44) KCNA3ELANEITGB3ITGA2BHTR2A
SCHEMBL7796400 0.91 MAPT (0.42) KCNA3ELANEITGB3ITGA2BHTR2A
SCHEMBL7786255 0.91 KCNA3 (0.41) KCNA3ITGB3ITGA2BHTR2AHTR2C
SCHEMBL7786481 0.90 HTR2A (0.41) KCNA3ELANEHTR2AHTR2CHTR2B
SCHEMBL7794815 0.90 HTR2A (0.41) KCNA3ELANEHTR2AHTR2CHTR2B

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