SCHEMBL7355606

SCHEMBL7355606

Cl[C@H]1CCCN(CCc2ccccc2)C1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.61
SIGMAR1 Q99720 1/20 0.59
ACHE P22303 1/20 0.53
DRD2 P14416 1/20 0.52
DRD3 P35462 1/20 0.52
CCR3 P51677 1/20 0.51

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
SCHEMBL7348929 1.00 SLC6A3 (0.61) SLC6A3SIGMAR1ACHEDRD2DRD3
SCHEMBL7348925 1.00 SLC6A3 (0.61) SLC6A3SIGMAR1ACHEDRD2DRD3
SCHEMBL8879791 0.86 L3MBTL1 (0.50) SLC6A3SIGMAR1
SCHEMBL4815665 0.85 CYP2D6 (0.68) SIGMAR1ACHE
SCHEMBL7354339 0.84 HTR2A (0.51) SLC6A3
SCHEMBL7354346 0.84 HTR2A (0.51) SLC6A3
SCHEMBL14279291 0.83 HRH3 (0.56)
SCHEMBL4814084 0.82 L3MBTL3 (0.58) SIGMAR1
SCHEMBL4814066 0.82 L3MBTL3 (0.58) SIGMAR1
SCHEMBL6795832 0.81 L3MBTL1 (0.51) SLC6A3SIGMAR1

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
EP-0889043-B1 5,11-DIHYDRODIBENZ b,e] 1,4]OXAZEPINE DERIVATIVES AND DRUG COMPOSITIONS CONTAING THE DERIVATIVES AJINOMOTO KK (JP) 2001-08-29 EP disclosed
US-6127361-A FOR TREATMENT OR PREVENTION OF GASTROINTESTINAL MOVING FUNCTION DISORDERS, IRRITABLE BOWEL SYNDROME AJINOMO CO., INC. (JP) 2000-10-03 US disclosed
EP-0889043-A1 5,11-DIHYDRODIBENZ b,e] 1,4]OXAZEPINE DERIVATIVES AND DRUG COMPOSITIONS CONTAING THE DERIVATIVES Ajinomoto Co., Inc. (JP) 1999-01-07 EP disclosed