SCHEMBL7441671

SCHEMBL7441671

CN1CCC[C@H]1COc1ccc(C=O)cc1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 3/20 0.59
▸ CHRNA4 P43681 3/20 0.59
▸ CHRNB4 P30926 3/20 0.59
▸ CHRNA3 P32297 3/20 0.59
▸ CHRNB1 P11230 2/20 0.59
▸ CHRNB3 Q05901 2/20 0.59

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
SCHEMBL7441682 1.00 CHRNB2 (0.59) CHRNB2CHRNA4CHRNB4CHRNA3CHRNB1
SCHEMBL4129880 0.96 CHRNB2 (0.54) CHRNB2CHRNA4CHRNB4CHRNA3CHRNB1
SCHEMBL4128207 0.87 HRH3 (0.50) CHRNB2CHRNA4CHRNB4CHRNA3CHRNB1
SCHEMBL6603836 0.87 CHRNB2 (0.54) CHRNB2CHRNA4CHRNB4CHRNA3CHRNB1
SCHEMBL4118891 0.85 HRH3 (0.48) —
SCHEMBL14174981 0.82 CHRNB2 (0.69) CHRNB2CHRNA4CHRNB4CHRNA3CHRNB1
SCHEMBL7488933 0.82 CHRNB2 (0.55) CHRNB2CHRNA4CHRNB4CHRNA3CHRNB1
SCHEMBL7488938 0.82 CHRNB2 (0.55) CHRNB2CHRNA4CHRNB4CHRNA3CHRNB1
SCHEMBL7488922 0.82 CHRNB2 (0.55) CHRNB2CHRNA4CHRNB4CHRNA3CHRNB1
SCHEMBL7488929 0.82 CHRNB2 (0.55) CHRNB2CHRNA4CHRNB4CHRNA3CHRNB1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0912567-B1 CARBOLINE DERIVATIVES ICOS CORP (US) 2002-04-10 — — EP disclosed
US-6306870-B1 PHOSPHODIESTERASE ENZYME INHIBITORS, CARDIOVASCULAR DISORDERS AND SEXUAL DISORDERS ICOS CORPORATION 2001-10-23 — — US disclosed
CN-1067071-C Carboline derivatives ICOS CORP (US) 2001-06-13 — — CN disclosed
US-6117881-A POTENT AND SELECTIVE INHIBITORS OF CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE SPECIFIC PHOSPHODIESTERASE ICOS CORPORATION (US) 2000-09-12 — — US disclosed
US-6043252-A A POTENT AND SELECTIVE INHIBITORS OF CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE SPECIFIC PHOSPHODIESTERASE (CGMP-SPECIFIC PDE); TREATING CARDIOVASCULAR DISORDERS AND ERECTILE DYSFUNCTION ICOS CORPORATION (US) 2000-03-28 — — US disclosed
CN-1218471-A Carboline derivatives ICOS CORP (US) 1999-06-02 — — CN disclosed
EP-0912567-A1 CARBOLINE DERIVATIVES ICOS CORPORATION (US) 1999-05-06 — — EP disclosed
WO-1997043287-A1 CARBOLINE DERIVATIVES ICOS CORPORATION (US) 1997-11-20 — — WO disclosed
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