SCHEMBL8938034

SCHEMBL8938034

O=P(O)(O)C(Cc1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 7/20 0.87
HTR2A P28223 2/20 0.51
HTR2B P41595 2/20 0.51
HTR2C P28335 1/20 0.51
PGK1 P00558 1/20 0.49
PGK2 P07205 1/20 0.49
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
MMP2 P08253 1/20 0.47
PNMT P11086 1/20 0.47
SLC6A4 P31645 2/20 0.46
SIGMAR1 Q99720 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
ADRA2C P18825 1/20 0.46
ADRA1A P35348 1/20 0.46
DRD3 P35462 1/20 0.46
OPRK1 P41145 1/20 0.46
EPHX1 P07099 2/20 0.45
CES2 O00748 1/20 0.43

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
SCHEMBL8956963 0.82 ACP3 (0.68) ACP3PGK1PGK2CA12CA1
SCHEMBL30438454 0.77 ACP3 (1.00) ACP3HTR2AHTR2BHTR2CPGK1
SCHEMBL8938038 0.77 ACP3 (0.90) ACP3PGK1PGK2CA12CA1
SCHEMBL8938031 0.77 ACP3 (1.00) ACP3HTR2AHTR2BHTR2CPGK1
SCHEMBL9401137 0.75 PGK1 (0.70) ACP3PGK1PGK2CA12CA1
SCHEMBL8824569 0.75 ACP3 (0.67) ACP3PGK1PGK2CA12CA1
SCHEMBL28631469 0.75 HTR2A (0.55) ACP3HTR2AHTR2BHTR2CPNMT
SCHEMBL9401118 0.74 ACP3 (0.65) ACP3PGK1PGK2CA12CA1
SCHEMBL12706099 0.74 HTR2A (0.68) ACP3HTR2AHTR2BHTR2CPNMT
SCHEMBL14334811 0.73 ACP3 (0.56) ACP3HTR2AHTR2BHTR2CPGK1

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
US-5508273-A ARALKYLPHOSPHONATES FOR OSTEOPOROSIS ORTHO PHARMACEUTICAL CORPORATION (US) 1996-04-16 US disclosed