SCHEMBL7792139

SCHEMBL7792139

CCOc1cc(OCC)c2c(c1)C(=O)c1cccc(OCCCC3CCCNC3)c1-2

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 6/20 0.41
NPY1R P25929 9/20 0.40
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
TTR P02766 1/20 0.37
KCNA3 P22001 1/20 0.37
EED O75530 1/20 0.37

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
SCHEMBL7786088 0.98 NPY1R (0.40) ACP1NPY1RHTR2AHTR2CHTR2B
SCHEMBL7786173 0.94 HTR2A (0.39) ACP1NPY1RHTR2AHTR2CHTR2B
SCHEMBL7794815 0.93 HTR2A (0.41) ACP1NPY1RHTR2AHTR2CHTR2B
SCHEMBL7786481 0.93 HTR2A (0.41) ACP1NPY1RHTR2AHTR2CHTR2B
SCHEMBL7795714 0.93 NPY1R (0.42) ACP1NPY1RKCNA3
SCHEMBL7794782 0.92 KCNA3 (0.41) NPY1RHTR2AHTR2CHTR2BTTR
SCHEMBL7795892 0.92 HTR2A (0.43) ACP1NPY1RHTR2AHTR2CHTR2B
SCHEMBL7794760 0.90 ACP1 (0.42) ACP1NPY1RKCNA3EED
SCHEMBL7786097 0.88 EED (0.44) ACP1NPY1RKCNA3EED
SCHEMBL7792794 0.87 NPY1R (0.41) ACP1NPY1RHTR2AHTR2CHTR2B

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