SCHEMBL10394690

SCHEMBL10394690

CC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1.CC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1.[Gd]

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.65
GABRB2 P47870 1/20 0.65
POLB P06746 1/20 0.50
MAPT P10636 3/20 0.44
GAA P10253 2/20 0.44
KDM4E B2RXH2 2/20 0.44
TSHR P16473 1/20 0.42
HTR1D P28221 2/20 0.42
ALDH1A1 P00352 3/20 0.41
ALOX15 P16050 2/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
RXRB P28702 5/20 0.41
RXRA P19793 4/20 0.41
RXRG P48443 3/20 0.41
LMNA P02545 1/20 0.40
TYR P14679 1/20 0.40
CYP2C19 P33261 1/20 0.39
HTR1B P28222 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
SCHEMBL93161 0.96 GABRA1 (0.69) GABRA1GABRB2POLBMAPTGAA
SCHEMBL10415675 0.92 GABRA1 (0.65) GABRA1GABRB2POLBMAPTGAA
SCHEMBL4572745 0.85 GABRA1 (0.58) GABRA1GABRB2POLBMAPTGAA
Formaldehyde SCHEMBL22558111 0.85 GABRA1 (0.58) GABRA1GABRB2POLBMAPTGAA
SCHEMBL26230931 0.82 GABRA1 (0.55) GABRA1GABRB2POLBMAPTGAA
SCHEMBL1655430 0.82 GABRA1 (0.55) GABRA1GABRB2POLBMAPTGAA
SCHEMBL10540685 0.82 GABRA1 (0.55) GABRA1GABRB2POLBMAPTGAA
SCHEMBL25485527 0.79 GABRA1 (0.60) GABRA1GABRB2POLBMAPTGAA
SCHEMBL22861023 0.79 GABRB2 (0.52) GABRA1GABRB2POLBMAPTGAA
SCHEMBL7763323 0.79 GABRA1 (0.52) GABRA1GABRB2POLBMAPTGAA

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
US-4973498-A Volatile lanthanum complexes for use in chemical vapor deposition THE BRITISH PETROLEUM COMPANY P.L.C. (GB) 1990-11-27 US disclosed
US-4894446-A Volatile lanthanum complexes and their uses THE BRITISH PETROLEUM COMPANY P.L.C. (GB) 1990-01-16 US disclosed
EP-0295829-A2 Volatile lanthanum complexes and their uses The British Petroleum Company p.l.c. (GB) 1988-12-21 EP disclosed