SCHEMBL27754237

SCHEMBL27754237

CC(CF)CC(C)(O)Cc1cc2ccccc2[nH]1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 11/20 0.45
PGR P06401 9/20 0.45
NR3C2 P08235 9/20 0.45
LOXL2 Q9Y4K0 1/20 0.42
CYP2D6 P10635 3/20 0.41
TACR1 P25103 1/20 0.39
TACR3 P29371 1/20 0.39
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
CASR P41180 1/20 0.39

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
SCHEMBL3945854 0.86 LOXL2 (0.46) NR3C1PGRNR3C2LOXL2CYP2D6
SCHEMBL3655671 0.85 LOXL2 (0.40) NR3C1PGRNR3C2LOXL2CYP2D6
SCHEMBL27754238 0.78 LOXL2 (0.44) NR3C1PGRNR3C2LOXL2CYP2D6
SCHEMBL3653908 0.78 NR3C1 (0.55) NR3C1PGRNR3C2LOXL2
SCHEMBL4431839 0.77 CASR (0.43) LOXL2CYP2D6MTNR1AMTNR1BCASR
SCHEMBL28246983 0.77 LOXL2 (0.55) NR3C1PGRNR3C2LOXL2CYP2D6
SCHEMBL5821510 0.75 LOXL2 (0.43) NR3C1PGRNR3C2LOXL2CYP2D6
SCHEMBL5860946 0.74 CYP2D6 (0.47) NR3C1PGRNR3C2LOXL2CYP2D6
SCHEMBL31280332 0.74 LOXL2 (0.55) NR3C1PGRNR3C2LOXL2MTNR1A
SCHEMBL9734545 0.73 LOXL2 (0.58) NR3C1PGRNR3C2LOXL2MTNR1A

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
CN-101522196-A Treatment of infections and their sequelae with combined isolated glucocorticoid receptor agonists and anti-infective agents BAUSCH & LOMB (US) 2009-09-02 CN disclosed
CN-101522187-A Compositions and methods for treating, reducing, ameliorating, or alleviating posterior-segment ophthalmic diseases BAUSCH & LOMB (US) 2009-09-02 CN disclosed