SCHEMBL3680206

SCHEMBL3680206

CC(C)n1cnc2c(Nc3ccc(Br)cc3)nc(N(CCO)CCO)nc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CCNE2 O96020 12/20 1.00
▸ CCNE1 P24864 12/20 1.00
▸ CDK2 P24941 12/20 1.00
▸ CDK5 Q00535 3/20 0.65
▸ CDK5R1 Q15078 2/20 0.65
▸ ATM Q13315 1/20 0.65
▸ CDK1 P06493 5/20 0.63
▸ FLT3 P36888 2/20 0.61
▸ CCNT1 O60563 1/20 0.59
▸ PDE5A O76074 1/20 0.59
▸ CCNB1 P14635 1/20 0.59
▸ CCNA2 P20248 1/20 0.59
▸ CDK7 P50613 1/20 0.59
▸ CDK9 P50750 1/20 0.59
▸ CCNH P51946 1/20 0.59
▸ MNAT1 P51948 1/20 0.59
▸ PDE4D Q08499 1/20 0.59
▸ PDE10A Q9Y233 1/20 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
SCHEMBL5828199 0.88 CDK2 (1.00) CCNE2CCNE1CDK2CDK5CDK5R1
SCHEMBL3681929 0.87 CCNE2 (0.77) CCNE2CCNE1CDK2CDK5CDK5R1
SCHEMBL6143053 0.86 CDK2 (1.00) CCNE2CCNE1CDK2CDK5CDK5R1
SCHEMBL3678763 0.81 CCNE2 (1.00) CCNE2CCNE1CDK2CDK5CDK5R1
SCHEMBL28771433 0.78 CDK2 (0.76) CCNE2CCNE1CDK2CDK5CDK5R1
SCHEMBL14071580 0.77 CDK2 (0.85) CCNE2CCNE1CDK2CDK5CDK5R1
SCHEMBL3680752 0.76 CCNE1 (0.82) CCNE2CCNE1CDK2CDK5CDK5R1
SCHEMBL1394958 0.74 CCNE2 (1.00) CCNE2CCNE1CDK2CDK5CDK5R1
SCHEMBL2364042 0.73 CDK1 (0.87) CCNE2CCNE1CDK2CDK5CDK5R1
SCHEMBL5827556 0.73 CCNE2 (0.78) CCNE2CCNE1CDK2CDK5CDK5R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1764118-B1 Polymer coating for medical devices GILEAD PALO ALTO INC (US) 2010-08-25 — — EP disclosed
EP-1937328-B1 POLYMER COATING FOR MEDICAL DEVICES CV THERAPEUTICS INC (US) 2009-08-26 — — EP disclosed
US-7419709-B2 Polymer coating for medical devices CV THERAPEUTICS, INC. (US) 2008-09-02 — — US disclosed
US-20080160166-A1 POLYMER COATING FOR MEDICAL DEVICES RYPACEK FRANTISEK 2008-07-03 — — US disclosed
US-7364768-B2 Polymer coating for medical devices CV THERAPEUTICS, INC. (US) 2008-04-29 — — US disclosed
US-20070071879-A1 Polymer coating for medical devices RYPACEK FRANTISEK 2007-03-29 — — US disclosed
US-20070071926-A1 Polymer coating for medical devices RYPACEK FRANTISEK 2007-03-29 — — US disclosed
EP-1764118-A2 Polymer coating for medical devices CV THERAPEUTICS, INC. (US) 2007-03-21 — — EP disclosed
US-7160592-B2 Polymer coating for medical devices CV THERAPEUTICS, INC. (US) 2007-01-09 — — US disclosed
US-20060093771-A1 Polymer coating for medical devices CV THERAPEUTICS, INC. 2006-05-04 — — US disclosed
US-20030219562-A1 Polymer coating for medical devices CV THERAPEUTICS, INC. 2003-11-27 — — US disclosed
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