SCHEMBL7533386

SCHEMBL7533386

Fc1cccc(OC2CN(C3CCC(c4c[nH]c5ccc(F)cc45)CC3)C2)c1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 9/20 0.57
SLC6A4 P31645 6/20 0.56
OPRM1 P35372 3/20 0.48
OPRK1 P41145 3/20 0.48
OPRL1 P41146 3/20 0.48
DRD1 P21728 1/20 0.47
SLC6A2 P23975 1/20 0.47
HTR1B P28222 1/20 0.47
HTR2A P28223 1/20 0.47
SLC6A3 Q01959 1/20 0.47
HTR7 P34969 1/20 0.46
HSD11B1 P28845 1/20 0.46

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
SCHEMBL7533383 1.00 HTR1A (0.57) HTR1ASLC6A4OPRM1OPRK1OPRL1
SCHEMBL7535111 1.00 HTR1A (0.57) HTR1ASLC6A4OPRM1OPRK1OPRL1
SCHEMBL7535549 0.92 HTR1A (0.61) HTR1ASLC6A4DRD1SLC6A2HTR1B
SCHEMBL7534720 0.92 HTR1A (0.61) HTR1ASLC6A4DRD1SLC6A2HTR1B
SCHEMBL7534723 0.92 HTR1A (0.61) HTR1ASLC6A4DRD1SLC6A2HTR1B
SCHEMBL7533322 0.92 HTR1A (0.52) HTR1ASLC6A4SLC6A2SLC6A3
SCHEMBL7533330 0.92 HTR1A (0.52) HTR1ASLC6A4SLC6A2SLC6A3
SCHEMBL7534385 0.92 HTR1A (0.52) HTR1ASLC6A4SLC6A2SLC6A3
SCHEMBL7937558 0.92 HTR1A (0.56) HTR1ASLC6A4OPRM1OPRK1OPRL1
SCHEMBL7534471 0.92 HTR1A (0.56) HTR1ASLC6A4OPRM1OPRK1OPRL1

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
EP-1228065-A1 (INDOL-3-YL)-CYCLOALKYL]-3-SUBSTITUTED AZETIDINES FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS Wyeth (US) 2002-08-07 EP claimed
US-6245799-B1 PSYCHOLOGICAL DISORDERS; ANTIDEPRESSANTS; ANXIOLYTIC AGENTS AMERICAN HOME PRODUCTS CORP 2001-06-12 US claimed
WO-2001034598-A1 [(INDOL-3-YL)-CYCLOALKYL]-3-SUBSTITUTED AZETIDINES FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS WYETH (US) 2001-05-17 WO claimed
EP-1228065-A1 (INDOL-3-YL)-CYCLOALKYL]-3-SUBSTITUTED AZETIDINES FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS Wyeth (US) 2002-08-07 EP disclosed
US-6245799-B1 PSYCHOLOGICAL DISORDERS; ANTIDEPRESSANTS; ANXIOLYTIC AGENTS AMERICAN HOME PRODUCTS CORP 2001-06-12 US disclosed
WO-2001034598-A1 [(INDOL-3-YL)-CYCLOALKYL]-3-SUBSTITUTED AZETIDINES FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS WYETH (US) 2001-05-17 WO disclosed