SCHEMBL7976323

SCHEMBL7976323

O=C1c2ccccc2C(=O)N1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.95

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.95
DRD3 P35462 4/20 0.95
MAOB P27338 4/20 0.71
ALDH1A1 P00352 1/20 0.64
POLB P06746 1/20 0.64
GAA P10253 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
NPSR1 Q6W5P4 1/20 0.64
HTR1A P08908 4/20 0.64

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 SCHEMBL10826808 0.99 DRD2 (0.92) DRD2DRD3MAOBALDH1A1POLB
SCHEMBL9256633 0.97 DRD2 (1.00) DRD2DRD3MAOBALDH1A1POLB
SCHEMBL10763449 0.95 DRD2 (0.95) DRD2DRD3MAOBALDH1A1POLB
SCHEMBL9733689 0.92 DRD2 (0.84) DRD2DRD3MAOBALDH1A1POLB
SCHEMBL31232750 0.92 DRD2 (0.84) DRD2DRD3MAOBALDH1A1POLB
SCHEMBL9258386 0.90 DRD2 (0.77) DRD2DRD3MAOBALDH1A1POLB
SCHEMBL6166099 0.88 DRD3 (0.79) DRD2DRD3MAOBALDH1A1POLB
SCHEMBL9256276 0.87 DRD2 (0.81) DRD2DRD3MAOBHTR1A
SCHEMBL9256958 0.86 DRD2 (0.79) DRD2DRD3MAOBHTR1A
SCHEMBL11148465 0.86 DRD2 (0.71) DRD2DRD3MAOBALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6255323-B1 Cyanoguanidine compounds SHIONOGI BIORESEARCH CORP. 2001-07-03 US disclosed
WO-2000061561-A1 CYANOGUANIDINE COMPOUNDS SHIONOGI BIORESEARCH CORP. (US) 2000-10-19 WO disclosed
US-5470851-A Antihistamine, anticoagulants SANKYO COMPANY, LIMITED (JP) 1995-11-28 US disclosed
EP-0463873-A1 Thiazolidinecarboxylic acid amide derivatives having anti-allergic activity, their preparation and their use Sankyo Company Limited (JP) 1992-01-02 EP disclosed
US-4673684-A Amide derivatives and 5-lipoxygenase inhibitors containing the same as an active ingredient TERUMO CORPORATION (JP) 1987-06-16 US disclosed
EP-0157420-A2 Amide derivatives and 5-lipoxygenase inhibitors containing the same as an active ingredient TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1985-10-09 EP disclosed