SCHEMBL17055437

SCHEMBL17055437

Cc1ccccc1[C@@H](O)c1ccc(F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.53
ATM Q13315 2/20 0.44
KMT2A Q03164 2/20 0.44
SLC6A9 P48067 1/20 0.41
ESR1 P03372 1/20 0.41
CHEK2 O96017 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
CYP2C9 P11712 1/20 0.40
ACP3 P15309 1/20 0.40
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
ALDH1A1 P00352 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
KCNH2 Q12809 1/20 0.38
AOC3 Q16853 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
SCHEMBL1585335 1.00 GAA (0.53) GAAATMKMT2ASLC6A9ESR1
SCHEMBL22770076 0.85 ATM (0.39) GAAATMKMT2AMEN1MAPT
SCHEMBL8805155 0.84 GAA (0.56) GAAKMT2AESR1CHEK2MEN1
SCHEMBL227491 0.84 GAA (0.65) GAAKMT2AESR1MEN1MAPT
SCHEMBL28973546 0.84 GAA (0.65) GAAKMT2AESR1MEN1MAPT
SCHEMBL3858791 0.84 GAA (0.65) GAAKMT2AESR1MEN1MAPT
SCHEMBL8496291 0.82 GAA (0.54) GAAKMT2AESR1CHEK2MEN1
SCHEMBL4191435 0.81 GAA (0.53) GAAATMKMT2AESR1CHEK2
SCHEMBL1349907 0.81 ATM (0.38) GAAATMKMT2ACYP2D6AOC3
SCHEMBL14528193 0.80 GAA (0.53) GAAACP3SLC6A2SLC6A4ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015128878-A1 NOVEL BENZOXAPHOSPHOLE COMPOUNDS AND A PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-09-03 WO disclosed