SCHEMBL7792670

SCHEMBL7792670

CCCOc1cc(OCC)cc2c1-c1c(OCCC3CCCN3)cccc1C2=O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.36
CHRNB4 P30926 2/20 0.36
CHRNA3 P32297 2/20 0.36
KCNA3 P22001 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
CHRNB2 P17787 1/20 0.35
CHRNA4 P43681 1/20 0.35
ELANE P08246 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
SCHEMBL7786158 0.97 TTR (0.38) TTRCHRNB4CHRNA3KCNA3HTR2A
SCHEMBL7794866 0.97 SSTR2 (0.37) TTRKCNA3HTR2AHTR2CHTR2B
SCHEMBL7791970 0.97 TTR (0.39) TTRCHRNB4CHRNA3KCNA3CHRNB2
SCHEMBL7792331 0.96 KCNA3 (0.40) CHRNB4CHRNA3KCNA3HTR2AHTR2C
SCHEMBL7792023 0.96 KCNA3 (0.40) CHRNB4CHRNA3KCNA3HTR2AHTR2C
SCHEMBL7791842 0.95 TTR (0.39) TTRCHRNB4CHRNA3KCNA3CHRNB2
SCHEMBL7792135 0.94 TTR (0.37) TTRKCNA3HTR2AHTR2CHTR2B
SCHEMBL7794727 0.94 TTR (0.39) TTRKCNA3
SCHEMBL7786316 0.93 CHRNB4 (0.42) TTRCHRNB4CHRNA3KCNA3
SCHEMBL7786122 0.93 KCNA3 (0.39) KCNA3HTR2AHTR2CHTR2BELANE

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