SCHEMBL8922982

SCHEMBL8922982

O=P(CN[C@@H](Cc1ccccc1)c1nnn[nH]1)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 4/20 0.39
MME P08473 3/20 0.39
AGTR2 P50052 1/20 0.39
ANPEP P15144 1/20 0.39
LAP3 P28838 1/20 0.39
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
PIN1 Q13526 1/20 0.34
TACR1 P25103 1/20 0.33
PLAU P00749 4/20 0.32
CYP1A2 P05177 2/20 0.32
PLAT P00750 2/20 0.32
F2 P00734 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
LMNA P02545 1/20 0.32
PLG P00747 1/20 0.31

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
SCHEMBL8922986 1.00 ECE1 (0.39) ECE1MMEAGTR2ANPEPLAP3
SCHEMBL8921559 0.93 MME (0.48) ECE1MMEAGTR2
SCHEMBL8921569 0.93 MME (0.48) ECE1MMEAGTR2
SCHEMBL8920739 0.85 PPARG (0.40) ECE1MMEAGTR2
SCHEMBL8922366 0.85 MME (0.42) ECE1MMEAGTR2KMT2APLAU
SCHEMBL8922375 0.85 MME (0.42) ECE1MMEAGTR2KMT2APLAU
SCHEMBL8920718 0.85 PPARG (0.40) ECE1MMEAGTR2
SCHEMBL8932548 0.85 ECE1 (0.43) ECE1MMEAGTR2HTTLMNA
SCHEMBL8921613 0.85 MME (0.43) ECE1MMEAGTR2KMT2A
SCHEMBL8932547 0.85 ECE1 (0.43) ECE1MMEAGTR2HTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0660840-B1 PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES CIBA GEIGY AG (CH) 1997-05-07 EP disclosed
WO-1996026729-A1 PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES AS ECE INHIBITORS CIBA-GEIGY AG (CH) 1996-09-06 WO disclosed
US-5550119-A ENDOTHELIN-CONVERTING ENZYM INHIBITORS CIBA-GEIGY CORPORATION (US) 1996-08-27 US disclosed
EP-0660840-A1 PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES. CIBA GEIGY AG (CH) 1995-07-05 EP disclosed
WO-1994005677-A1 PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES CIBA-GEIGY AG (CH) 1994-03-17 WO disclosed