SCHEMBL7480273

SCHEMBL7480273

O[C@@H]1c2cc3c(cc2C[C@H]1NC1CCN(c2cccc4c2OCCC4)CC1)OCO3

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 13/20 0.50
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40
DRD2 P14416 1/20 0.36
DRD1 P21728 1/20 0.36

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
SCHEMBL7480063 1.00 HTR1A (0.50) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL7483007 1.00 HTR1A (0.50) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL7480058 1.00 HTR1A (0.50) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL6583915 0.86 HTR1A (0.45) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL7481799 0.86 HTR1A (0.68) HTR1AADRA1DADRA1AADRA1B
SCHEMBL7481855 0.86 HTR1A (0.68) HTR1AADRA1DADRA1AADRA1B
SCHEMBL7481792 0.86 HTR1A (0.68) HTR1AADRA1DADRA1AADRA1B
SCHEMBL7481862 0.86 HTR1A (0.68) HTR1AADRA1DADRA1AADRA1B
SCHEMBL7479086 0.85 HTR1A (0.59) HTR1AADRA1DADRA1AADRA1B
SCHEMBL7481888 0.85 HTR1A (0.59) HTR1AADRA1DADRA1AADRA1B

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-0982305-B1 Indane-1-ol derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2002-03-06 EP claimed
US-6153625-A Indan-1-ol compounds ADIR ET COMPAGNIE (FR) 2000-11-28 US claimed
EP-0982305-A1 Indane-1-ol derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-03-01 EP claimed