SCHEMBL8340748

SCHEMBL8340748

c1ccc(CN2CCN3c4ccccc4CCC3C2)cc1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 3/20 0.58
DRD2 P14416 2/20 0.54
SIGMAR1 Q99720 3/20 0.49
HTR2C P28335 3/20 0.49
HTR2B P41595 3/20 0.49
HTR1A P08908 1/20 0.49
GRIN1 Q05586 1/20 0.47
GRIN2B Q13224 1/20 0.47

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
SCHEMBL11594479 0.86 DRD2 (0.66) DRD3DRD2SIGMAR1HTR2CHTR1A
SCHEMBL19878686 0.85 DRD2 (0.46) DRD3DRD2SIGMAR1HTR1A
SCHEMBL19878684 0.85 DRD2 (0.46) DRD3DRD2SIGMAR1HTR1A
SCHEMBL1351856 0.84 DRD2 (0.55) DRD3DRD2SIGMAR1HTR1AGRIN1
SCHEMBL3824832 0.82 DRD3 (0.52) DRD3
SCHEMBL3824836 0.82 DRD3 (0.52) DRD3
SCHEMBL3818836 0.82 HTR2C (0.54) DRD2SIGMAR1HTR2CHTR2B
SCHEMBL3818838 0.82 HTR2C (0.54) DRD2SIGMAR1HTR2CHTR2B
SCHEMBL19878791 0.81 HTR2C (0.52) DRD2SIGMAR1HTR2CHTR2BHTR1A
SCHEMBL19878869 0.81 HTR2C (0.52) DRD2SIGMAR1HTR2CHTR2BHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5889010-A PSYCHOLOGICAL DISORDERS; UROGENITAL DISORDERS; COGNITION ACTIVATORS; NERVOUS SYSTEM DISORDERS; VISION DEFECTS; CONGESTIVE HEART FAILURE; DRUG ABRUSE; PARKINSON'S DISEASE;ANTIINFLAMMATORY AGENTS; ANTIALLERGENS PFIZER INC. (US) 1999-03-30 US disclosed
EP-0775118-A1 BENZIMIDAZOLE DERIVATIVES HAVING DOPAMINERGIC ACTIVITY PFIZER INC. (US) 1997-05-28 EP disclosed
WO-1996004250-A1 BENZIMIDAZOLE DERIVATIVES HAVING DOPAMINERGIC ACTIVITY PFIZER INC. (US) 1996-02-15 WO disclosed