SCHEMBL6244483

SCHEMBL6244483

CC(C)c1ccc([O])c(-c2ccccc2)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABRA1 P14867 3/20 0.45
▸ GABRB1 P18505 2/20 0.45
▸ GABRB2 P47870 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ CA1 P00915 2/20 0.45
▸ CA2 P00918 2/20 0.45
▸ FAAH O00519 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ GABRG2 P18507 1/20 0.45
▸ PTGS1 P23219 1/20 0.45
▸ SLC6A2 P23975 1/20 0.45
▸ HTR2C P28335 1/20 0.45
▸ GABRB3 P28472 1/20 0.45
▸ GABRA5 P31644 1/20 0.45
▸ GABRA3 P34903 1/20 0.45
▸ HTR2B P41595 1/20 0.45
▸ GABRA2 P47869 1/20 0.45

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
SCHEMBL29587166 0.81 GABRA1 (0.48) GABRA1GABRB1GABRB2LMNACA1
SCHEMBL27619933 0.76 GABRA1 (0.50) GABRA1GABRB1GABRB2LMNACA1
SCHEMBL28412354 0.76 PDE4B (0.46) GABRA1GABRB1GABRB2LMNACA1
SCHEMBL8134144 0.74 GABRA1 (0.42) GABRA1GABRB1GABRB2LMNACA1
SCHEMBL11968721 0.73 ELANE (0.43) GABRA1GABRB1GABRB2LMNACA1
SCHEMBL619043 0.72 GABRA1 (0.61) GABRA1GABRB1GABRB2LMNACA1
SCHEMBL16528000 0.71 GABRA1 (0.59) GABRA1GABRB1GABRB2LMNACA1
SCHEMBL27705273 0.69 PDE4A (0.41) GABRA1GABRB1PTGS1PDE4APDE4B
SCHEMBL6237508 0.69 HDAC4 (0.47) LMNACA1CA2CYP1A2CYP3A4
SCHEMBL31546110 0.69 PDE4B (0.50) GABRA1GABRB1GABRB2LMNACA1

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-1063252-B1 FLAME-RETARDANT RESIN, COMPOSITION THEREOF, AND PROCESS FOR PRODUCING THE SAME OTSUKA KAGAKU KK (JP) 2005-06-08 — — EP disclosed
US-6632891-B1 Obtained by an ester exchange reaction between the flame retardant phosphazene and the polycarbonate or polyester resin OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2003-10-14 — — US disclosed
EP-1063252-A1 FLAME-RETARDANT RESIN, COMPOSITION THEREOF, AND PROCESS FOR PRODUCING THE SAME OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2000-12-27 — — EP disclosed
Send feedback