SCHEMBL9423780

SCHEMBL9423780

BOC(=O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A2 O00482 1/20 0.50
NR5A1 Q13285 1/20 0.50
GLRA3 O75311 1/20 0.41
GLRB P48167 1/20 0.41
HSP90AA1 P07900 1/20 0.39
CA2 P00918 3/20 0.38
CA1 P00915 2/20 0.38
ALOX5 P09917 3/20 0.38
PTGS2 P35354 3/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
POLB P06746 1/20 0.37
TYR P14679 1/20 0.37
CYP1A2 P05177 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 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
SCHEMBL1530144 0.85 NR5A2 (0.55) NR5A2NR5A1GLRA3GLRBHSP90AA1
SCHEMBL30314144 0.85 NR5A2 (0.55) NR5A2NR5A1GLRA3GLRBHSP90AA1
SCHEMBL28362871 0.83 NR5A2 (0.50) NR5A2NR5A1GLRA3GLRBHSP90AA1
SCHEMBL27491911 0.82 NR5A2 (0.52) NR5A2NR5A1GLRA3GLRBHSP90AA1
SCHEMBL27195660 0.80 NR5A2 (0.56) NR5A2NR5A1GLRA3GLRBHSP90AA1
SCHEMBL29670054 0.80 NR5A2 (0.56) NR5A2NR5A1GLRA3GLRBHSP90AA1
SCHEMBL30861606 0.80 NR5A2 (0.56) NR5A2NR5A1GLRA3GLRBHSP90AA1
SCHEMBL28742131 0.80 NR5A2 (0.56) NR5A2NR5A1GLRA3GLRBHSP90AA1
SCHEMBL6858504 0.79 NR5A2 (0.55) NR5A2NR5A1GLRA3GLRBHSP90AA1
SCHEMBL132940 0.79 NR5A2 (0.55) NR5A2NR5A1GLRA3GLRBHSP90AA1

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-5281502-A Tri-level imaging processes with adjustable color XEROX CORPORATION (US) 1994-01-25 US claimed
US-5281502-A Tri-level imaging processes with adjustable color XEROX CORPORATION (US) 1994-01-25 US disclosed