SCHEMBL6276897

SCHEMBL6276897

CC(C)c1ccccc1C1CO1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
GABRA1 P14867 3/20 0.40
GABRB2 P47870 2/20 0.40
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
FAAH O00519 2/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
GABRB1 P18505 1/20 0.37
PTGS1 P23219 1/20 0.37
SLC6A2 P23975 1/20 0.37
HTR2C P28335 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
HTR2B P41595 1/20 0.37
GABRA2 P47869 1/20 0.37

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
SCHEMBL28281952 0.80 GSTO1 (0.32) GABRA1GABRB2LMNAGSTO1
SCHEMBL31610743 0.78 GABRA1 (0.39) TSHRGABRA1GABRB2GABRG2GABRB3
SCHEMBL17297749 0.78 GABRA1 (0.39) TSHRGABRA1GABRB2GABRG2GABRB3
SCHEMBL21765348 0.77 GABRA1 (0.34) GABRA1GABRB2CA1CA2GABRB1
SCHEMBL37732 0.77 TSHR (0.57) TSHRHTR2ACHRM2CHRM4CHRM1
SCHEMBL25204867 0.76 DRD2 (0.45) SLC6A2HTR2BHTR2A
SCHEMBL17865232 0.75 HTR2B (0.41) TSHRLMNACYP1A2SLC6A2HTR2C
SCHEMBL19729054 0.75 LTB4R (0.37) GABRA1GABRB2CA1CA2LMNA
SCHEMBL27259988 0.74 ADRA2A (0.47) TSHRGABRA1GABRB2GABRG2GABRB3
SCHEMBL25478404 0.72 NR3C2 (0.32)

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-1317460-A4 COMPOUNDS CONTAINING OXAZOLIDINONE MOIETY AND USES THEREOF UNIV COLORADO STATE RES FOUND (US) 2005-04-20 EP disclosed
EP-1317460-A1 COMPOUNDS CONTAINING OXAZOLIDINONE MOIETY AND USES THEREOF COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2003-06-11 EP disclosed
WO-2002018391-A1 COMPOUNDS CONTAINING OXAZOLIDINONE MOIETY AND USES THEREOF COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2002-03-07 WO disclosed