SCHEMBL7499205

SCHEMBL7499205

CC(C)(C)OC(=O)C(N)C1CN(Cc2ccccc2)CCO1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DRD4 P21917 14/20 0.44
▸ DRD2 P14416 4/20 0.42
▸ DRD3 P35462 4/20 0.42
▸ CNR2 P34972 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ GRIN2B Q13224 1/20 0.39
▸ LTA4H P09960 1/20 0.39

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
SCHEMBL7387452 0.81 GPR119 (0.47) CYP2D6CYP2C9
SCHEMBL4640527 0.80 S1PR5 (0.44) LTA4H
SCHEMBL4640533 0.80 S1PR5 (0.44) LTA4H
SCHEMBL4640541 0.80 S1PR5 (0.44) LTA4H
SCHEMBL28012277 0.80 DRD4 (0.52) DRD4DRD2DRD3
SCHEMBL7390364 0.78 GPR119 (0.49) CYP2D6CYP2C9
SCHEMBL28012178 0.77 YAP1 (0.44) —
SCHEMBL28011729 0.77 YAP1 (0.44) —
SCHEMBL31293154 0.77 DRD4 (0.47) DRD4DRD2DRD3CNR2CYP1A2
SCHEMBL1759442 0.77 DRD4 (0.55) DRD4DRD2DRD3CNR2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0723545-B1 QUINOLIZINONE TYPE COMPOUNDS ABBOTT LAB (US) 2002-05-08 — — EP disclosed
CN-1053188-C Quinolizinone type compounds ABBOTT LAB (US) 2000-06-07 — — CN disclosed
US-5726182-A TREATMENT OF BACTERIAL INFECTIONS ABBOTT LABORATORIES (US) 1998-03-10 — — US disclosed
EP-0774460-A1 BENZOIC ACID COMPOUND AND USE THEREOF AS MEDICINE YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-05-21 — — EP disclosed
US-5599816-A BACTERICIDE ABBOTT LABORATORIES (US) 1997-02-04 — — US disclosed
WO-1996039407-A1 QUINOLIZINONE TYPE COMPOUNDS ABBOTT LABORATORIES (US) 1996-12-12 — — WO disclosed
CN-1137273-A Quinolizinone type compounds ABBOTT LAB (US) 1996-12-04 — — CN disclosed
US-5580872-A ADMINISTERING IN THE TREATMENT OF BACTERIAL INFECTIONS ABBOTT LABORATORIES (US) 1996-12-03 — — US disclosed
EP-0723545-A1 QUINOLIZINONE TYPE COMPOUNDS ABBOTT LABORATORIES (US) 1996-07-31 — — EP disclosed
WO-1995010519-A1 QUINOLIZINONE TYPE COMPOUNDS ABBOTT LABORATORIES (US) 1995-04-20 — — WO disclosed
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