SCHEMBL7528050

SCHEMBL7528050

CCOP(=O)(CCCN)CP(=O)(O)O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
BLM P54132 2/20 0.48
CYP3A4 P08684 1/20 0.48
NFKB1 P19838 1/20 0.48
PMP22 Q01453 1/20 0.48
CYP1A2 P05177 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
GABBR2 O75899 3/20 0.47
GABBR1 Q9UBS5 3/20 0.47
GABRR1 P24046 1/20 0.46
TSHR P16473 1/20 0.45
THPO P40225 1/20 0.45
PPARD Q03181 1/20 0.38

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
SCHEMBL2959705 0.93 CYP1A2 (0.41) LMNABLMCYP3A4NFKB1PMP22
SCHEMBL5664086 0.83 TSHR (0.41) LMNABLMCYP3A4NFKB1PMP22
SCHEMBL9701509 0.81 PPARD (0.47) TSHRPPARD
SCHEMBL9701504 0.80 PPARD (0.46) LMNAPPARD
SCHEMBL9700806 0.80 PPARD (0.46) LMNAPPARD
SCHEMBL9702638 0.80 PPARD (0.46) LMNAPPARD
Water SCHEMBL9701709 0.79 PPARD (0.44) LMNAPPARD
SCHEMBL9062818 0.79 GABBR2 (0.55) LMNABLMCYP3A4NFKB1PMP22
SCHEMBL9700840 0.77 LPAR3 (0.42) LMNATSHRPPARD
SCHEMBL5701855 0.77 S1PR2 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020103161-A1 Novel heterocycles ARIAD PHARMACEUTICALS, INC. 2002-08-01 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-20020103161-A1 Novel heterocycles BMP2, SOST, BMP4 LMNA 2935/4885BLM 2567/4885CYP3A4 4615/4885

“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.