SCHEMBL6933008

SCHEMBL6933008

CCCCC(CCC)(CCCC)OP(=O)(OC(CCC)(CCCC)CCCC)OC(CCC)(CCCC)CCCC

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.44
FDPS P14324 12/20 0.39
TSHR P16473 1/20 0.39
SMPD1 P17405 3/20 0.38
GGPS1 O95749 7/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL5909126 1.00 CYP3A4 (0.44) CYP3A4FDPSTSHRSMPD1GGPS1
SCHEMBL9660270 0.91 SMPD1 (0.48) CYP3A4FDPSSMPD1GGPS1
SCHEMBL7867849 0.91 SMPD1 (0.48) CYP3A4FDPSSMPD1GGPS1
SCHEMBL1665179 0.91 SMPD1 (0.48) CYP3A4FDPSSMPD1GGPS1
SCHEMBL9615787 0.91 SMPD1 (0.48) CYP3A4FDPSSMPD1GGPS1
SCHEMBL2889917 0.91 SMPD1 (0.47) CYP3A4FDPSSMPD1GGPS1TRPM8
SCHEMBL5908957 0.91 CYP3A4 (0.40) CYP3A4FDPSTSHRSMPD1GGPS1
SCHEMBL9657882 0.89 SMPD1 (0.50) CYP3A4FDPSSMPD1GGPS1
SCHEMBL8040337 0.89 SMPD1 (0.50) CYP3A4FDPSSMPD1GGPS1
SCHEMBL9659789 0.89 SMPD1 (0.50) CYP3A4FDPSSMPD1GGPS1

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-4220627-A SEPARATION BY CONVERSION TO ARSENATE AND METAL SULFATE OUTOKUMPU OY (FI) 1980-09-02 US claimed
EP-0684270-B1 Aliphatic polyester carbonate and process for producing the same MITSUBISHI GAS CHEMICAL CO (JP) 2003-12-17 EP disclosed
US-5654380-A REACTING ALIPHATIC DIHYDROXY COMPOUND WITH ALIPHATIC DIBASIC ACID IN PRESENCE OF ESTER EXCHANGE CATALYST TO FORM POLYESTER OLIGOMER, REACTING WITH DIARYL CARBONATE TO FORM POLYESTER CARBONATE, ADDING PHOSPHORUS COMPOUND MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1997-08-05 US disclosed
EP-0684270-A2 Aliphatic polyester carbonate and process for producing the same MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1995-11-29 EP disclosed
US-4220627-A SEPARATION BY CONVERSION TO ARSENATE AND METAL SULFATE OUTOKUMPU OY (FI) 1980-09-02 US disclosed