SCHEMBL8050832

SCHEMBL8050832

CC(C)(Cc1ccccc1)OP(=O)(O)Oc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.51
SRC P12931 1/20 0.47
FDPS P14324 1/20 0.46
ANPEP P15144 2/20 0.45
LAP3 P28838 2/20 0.45
TSHR P16473 1/20 0.43
MEN1 O00255 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
BTN3A1 O00481 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
SCHEMBL28624801 0.85 ALDH1A1 (0.47) ALDH1A1SRCFDPSANPEPLAP3
SCHEMBL11121914 0.82 ALDH1A1 (0.52) ALDH1A1SRCANPEPLAP3POLB
SCHEMBL525387 0.81 SRC (0.55) ALDH1A1SRCANPEPLAP3POLB
SCHEMBL11714349 0.80 SRC (0.53) ALDH1A1SRCANPEPLAP3POLB
SCHEMBL11787671 0.78 SRC (0.52) ALDH1A1SRCANPEPLAP3POLB
SCHEMBL3684499 0.78 ALDH1A1 (0.43) ALDH1A1SRCKMT2APOLB
SCHEMBL8040541 0.77 ALDH1A1 (0.50) ALDH1A1SRCANPEPLAP3POLB
Biphenyl SCHEMBL190156 0.77 SRC (0.50) ALDH1A1SRCANPEPLAP3POLB
Ethylbenzene SCHEMBL28759672 0.76 CYP2C19 (0.56) ALDH1A1SRCANPEPLAP3TSHR
SCHEMBL28898519 0.75 SRC (0.57) ALDH1A1SRCANPEPLAP3MEN1

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
US-6075158-A CATALYTIC REACTING A TRIARYL PHOSPHATE WITH AN ALCOHOL IN THE PRESENCE OF A BASE TO PRODUCE THE PHOSPHATE ESTER PRODUCT GREAT LAKES CHEMICAL CORPORATION (US) 2000-06-13 US claimed
US-6075158-A CATALYTIC REACTING A TRIARYL PHOSPHATE WITH AN ALCOHOL IN THE PRESENCE OF A BASE TO PRODUCE THE PHOSPHATE ESTER PRODUCT GREAT LAKES CHEMICAL CORPORATION (US) 2000-06-13 US disclosed
EP-0775147-B1 TRANSESTERIFICATION PROCESS FMC CORP UK LTD (GB) 1999-12-15 EP disclosed
EP-0775147-A1 TRANSESTERIFICATION PROCESS FMC Corporation (UK) Limited (GB) 1997-05-28 EP disclosed
WO-1996005208-A1 TRANSESTERIFICATION PROCESS FMC CORPORATION (UK) LIMITED (GB) 1996-02-22 WO disclosed