SCHEMBL14372107

SCHEMBL14372107

CC(C)(C)c1cc(N(O)c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.52
GABRB2 P47870 1/20 0.52
RXRA P19793 10/20 0.40
RXRB P28702 10/20 0.40
RXRG P48443 9/20 0.40
CYP2C19 P33261 2/20 0.39
POLB P06746 1/20 0.37
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 1/20 0.35
TYR P14679 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL13673476 0.84 GABRA1 (0.52) GABRA1GABRB2RXRARXRBRXRG
SCHEMBL14372106 0.80 GABRA1 (0.48) GABRA1GABRB2RXRARXRBRXRG
SCHEMBL93161 0.76 GABRA1 (0.69) GABRA1GABRB2RXRARXRBRXRG
SCHEMBL7718944 0.76 RXRA (0.59) RXRARXRBRXRGALDH1A1ALOX15
SCHEMBL345598 0.76 GABRA1 (0.48) GABRA1GABRB2RXRARXRBRXRG
SCHEMBL22181552 0.76 GABRA1 (0.48) GABRA1GABRB2RXRARXRBRXRG
SCHEMBL23051506 0.74 GABRA1 (0.46) GABRA1GABRB2RXRARXRBRXRG
SCHEMBL10929184 0.74 LMNA (0.52) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL24522084 0.74 GABRA1 (0.46) GABRA1GABRB2RXRARXRBRXRG
SCHEMBL10394690 0.73 GABRA1 (0.65) GABRA1GABRB2RXRARXRBRXRG

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
US-20070231744-A1 Holographic recording medium KABUSHIKI KAISHA TOSHIBA (JP) 2007-10-04 US disclosed
US-20070231744-A1 Holographic recording medium KABUSHIKI KAISHA TOSHIBA (JP) 2007-10-04 US disclosed