SCHEMBL5049759

SCHEMBL5049759

CC(C)c1cc[c]c(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.32
GABRB2 P47870 1/20 0.32
GABRB1 P18505 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
LMNA P02545 2/20 0.31
HTT P42858 2/20 0.31
MAPT P10636 1/20 0.31
GCGR P47871 1/20 0.31
TP53 P04637 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL9933562 0.81 GABRA1 (0.32) GABRA1GABRB2
SCHEMBL7201334 0.77 GABRA1 (0.39) GABRA1GABRB2GABRB1LMNAHPGD
SCHEMBL8134144 0.75 GABRA1 (0.42) GABRA1GABRB2GABRB1PDE4APDE4B
SCHEMBL7070227 0.75 BRD4 (0.36) LMNAHTTMAPTTP53HPGD
SCHEMBL7066663 0.74 GABRA1 (0.35) GABRA1GABRB2HPGD
SCHEMBL15833732 0.73 GABRA1 (0.48) GABRA1GABRB2GABRB1PDE4APDE4B
SCHEMBL891578 0.72 LMNA (0.36) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL15757985 0.71 ALDH1A1 (0.37) LMNAHTTMAPT
SCHEMBL8112261 0.71 CYP2A6 (0.37) LMNAHTTMAPTTSHR
SCHEMBL15757626 0.71 LMNA (0.34) LMNAHTTMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1981898-A2 METAL COMPLEXES OF CYCLOMETALLATED IMIDAZOÝ1,2-f¨PHENANTHRIDINE AND DIIMIDAZOÝ1,2-A:1',2'-C¨QUINAZOLINE LIGANDS AND ISOELECTRONIC AND BENZANNULATED ANALOGS THEREOF Universal Display Corporation (US) 2008-10-22 EP claimed
WO-2007095118-A2 METAL COMPLEXES OF CYCLOMETALLATED IMIDAZO[1,2-f]PHENANTHRIDINE AND DIIMIDAZO[1,2-A:1',2'-C]QUINAZOLINE LIGANDS AND ISOELECTRONIC AND BENZANNULATED ANALOGS THEREOF UNIVERSAL DISPLAY CORPORATION (US) 2007-08-23 WO claimed