SCHEMBL10745008

SCHEMBL10745008

Oc1cc2c(cc1C(F)(F)F)CCNCC2c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD1 P21728 16/20 0.74
▸ DRD2 P14416 10/20 0.74
▸ KDM4E B2RXH2 4/20 0.74
▸ DRD5 P21918 4/20 0.74
▸ HPGD P15428 3/20 0.74
▸ MAPT P10636 3/20 0.74
▸ ADCY5 O95622 2/20 0.74
▸ CYP3A4 P08684 2/20 0.74
▸ NFKB1 P19838 2/20 0.74
▸ THPO P40225 2/20 0.74
▸ HIF1A Q16665 2/20 0.74
▸ HSD17B10 Q99714 2/20 0.74
▸ ADCY6 O43306 1/20 0.74
▸ ADCY3 O60266 1/20 0.74
▸ ADCY9 O60503 1/20 0.74
▸ ADCY8 P40145 1/20 0.74
▸ ADCY7 P51828 1/20 0.74
▸ ADCY2 Q08462 1/20 0.74
▸ ADCY1 Q08828 1/20 0.74
▸ ADCY4 Q8NFM4 1/20 0.74

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
Hydrochloric Acid SCHEMBL10748870 0.99 DRD1 (0.74) DRD1DRD2KDM4EDRD5HPGD
Skf-38393 SCHEMBL29389401 0.85 DRD1 (1.00) DRD1DRD2KDM4EDRD5HPGD
(R)-Skf-38393 SCHEMBL7941051 0.85 DRD1 (1.00) DRD1DRD2KDM4EDRD5HPGD
Skf-38393 SCHEMBL469578 0.85 DRD1 (1.00) DRD1DRD2KDM4EDRD5HPGD
(R)-Skf-38393 SCHEMBL7201583 0.84 DRD1 (1.00) DRD1DRD2KDM4EDRD5HPGD
Skf-38393 SCHEMBL3425787 0.84 DRD1 (1.00) DRD1DRD2KDM4EDRD5HPGD
(R)-Skf-38393 SCHEMBL7201396 0.84 DRD1 (1.00) DRD1DRD2KDM4EDRD5HPGD
Skf-38393 SCHEMBL1874365 0.84 DRD1 (1.00) DRD1DRD2KDM4EDRD5HPGD
Skf-38393 SCHEMBL29387587 0.84 DRD1 (1.00) DRD1DRD2KDM4EDRD5HPGD
(R)-Skf-38393 SCHEMBL29634867 0.84 DRD1 (1.00) DRD1DRD2KDM4EDRD5HPGD

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-0244088-A2 1-Phenyl-3-benzazepine compounds and medicaments containing these compounds for treating gastrointestinal motility disorders SMITHKLINE BEECHAM CORPORATION (US) 1987-11-04 — — EP claimed
EP-0244088-A2 1-Phenyl-3-benzazepine compounds and medicaments containing these compounds for treating gastrointestinal motility disorders SMITHKLINE BEECHAM CORPORATION (US) 1987-11-04 — — EP disclosed
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