SCHEMBL6320571

SCHEMBL6320571

COc1cc(/C=C(/CNc2ccc(C)nc2C)P2(=O)OCC(C)(C)CO2)ccc1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
APP P05067 2/20 0.36
GAA P10253 5/20 0.36
GLO1 Q04760 3/20 0.36
ABL1 P00519 1/20 0.36
ALDH1A1 P00352 5/20 0.35
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C9 P11712 2/20 0.35
TSHR P16473 2/20 0.35
HSD17B10 Q99714 2/20 0.35
MAPK1 P28482 2/20 0.35
TXNRD1 Q16881 2/20 0.35
TXNRD3 Q86VQ6 2/20 0.35
TXNRD2 Q9NNW7 2/20 0.35
KDM4E B2RXH2 2/20 0.35
HPGD P15428 2/20 0.35
TDP1 Q9NUW8 2/20 0.35

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
SCHEMBL6320578 1.00 MAPT (0.38) MAPTSMN1; SMN2APPGAAGLO1
SCHEMBL6317812 0.78
SCHEMBL6317816 0.78
SCHEMBL6318095 0.71 KMT2A (0.32) MAPTSMN1; SMN2GAAALDH1A1KMT2A
SCHEMBL6319409 0.69 GAA (0.33) MAPTGAACYP2C9HSD17B10KDM4E
SCHEMBL6324972 0.68 SMN1; SMN2 (0.42) MAPTSMN1; SMN2APPGAAGLO1
SCHEMBL6272311 0.67 CYP1A2 (0.32) GAACYP2C9CYP2C19CYP1A2CYP3A4
SCHEMBL6324975 0.67 SMN1; SMN2 (0.40) MAPTSMN1; SMN2APPGAAGLO1
SCHEMBL6322972 0.66 SLC22A3 (0.37) GAAALDH1A1KMT2AMEN1TSHR
SCHEMBL6321015 0.65 CYP1A2 (0.34) GAACYP2C9CYP2C19CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050143349-A1 Phosphorus containing compounds useful for the regulation of LDL and Lp(a) levels QUATRX PHARMACEUTICALS CO. 2005-06-30 US claimed
US-20050143349-A1 Phosphorus containing compounds useful for the regulation of LDL and Lp(a) levels QUATRX PHARMACEUTICALS CO. 2005-06-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050143349-A1 Phosphorus containing compounds useful for the regulation of LDL and Lp(a) levels APOB, LDLR, LPL MAPT 4686/4885SMN1; SMN2 4738/4885APP 374/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.