SCHEMBL3884599

SCHEMBL3884599

Cc1ccccc1C(CP(=O)(O)O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 8/20 0.65
SRC P12931 1/20 0.46
NR3C2 P08235 1/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP19A1 P11511 1/20 0.40
ANPEP P15144 1/20 0.40

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
SCHEMBL3884606 0.91 ACP3 (0.61) ACP3SRCMEN1CYP1A2KMT2A
SCHEMBL875769 0.81 SRC (0.60) ACP3SRCANPEP
SCHEMBL3889176 0.81 ACP3 (0.58) ACP3SRCNR3C2CYP19A1
SCHEMBL777640 0.79 SRC (0.46) ACP3SRCCYP3A4CYP19A1
SCHEMBL3893129 0.79 ACP3 (0.54) ACP3SRCNR3C2MEN1CYP1A2
SCHEMBL3896709 0.79 ACP3 (0.49) ACP3SRC
SCHEMBL3884830 0.79 ACP3 (1.00) ACP3SRC
SCHEMBL14509741 0.77 CYP2C9 (0.50) ACP3NR3C2MEN1CYP1A2CYP3A4
SCHEMBL2350960 0.75 HTR2A (0.50) ACP3NR3C2CYP1A2CYP3A4CYP2C9
SCHEMBL28062031 0.75 HPGD (0.51) ACP3NR3C2MEN1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 US disclosed
US-20150188192-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-02 US disclosed
US-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed