SCHEMBL7269691

SCHEMBL7269691

O=C1CC(=O)N(C2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)C(=O)N1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 2/20 0.50
UMPS P11172 5/20 0.48
DNPH1 O43598 1/20 0.48
HPRT1 P00492 1/20 0.47
P2RY2 P41231 2/20 0.45
LDHA P00338 1/20 0.45
P2RY6 Q15077 1/20 0.45
ATIC P31939 2/20 0.44
GART P22102 1/20 0.44
TAS1R3 Q7RTX0 1/20 0.44
TAS1R1 Q7RTX1 1/20 0.44

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
SCHEMBL1364683 1.00 FBP1 (0.50) FBP1UMPSDNPH1HPRT1P2RY2
SCHEMBL19370845 1.00 FBP1 (0.50) FBP1UMPSDNPH1HPRT1P2RY2
SCHEMBL25834288 0.91 P2RY2 (0.43) UMPSDNPH1P2RY2P2RY6
SCHEMBL11178912 0.79 HPRT1 (0.53) FBP1UMPSDNPH1HPRT1P2RY2
SCHEMBL31685403 0.74 FBP1 (0.46) FBP1UMPSDNPH1HPRT1P2RY2
SCHEMBL11758791 0.72 CDA (0.62) FBP1UMPSDNPH1HPRT1P2RY2
SCHEMBL21067752 0.72 NT5E (0.30)
SCHEMBL11755358 0.72 CDA (0.62) FBP1UMPSDNPH1HPRT1P2RY2
SCHEMBL11755974 0.72 HPRT1 (0.53) FBP1UMPSDNPH1HPRT1P2RY2
SCHEMBL11760447 0.72 HPRT1 (0.53) FBP1UMPSDNPH1HPRT1P2RY2

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-20030138432-A1 Selective cellular targeting: multifunctional delivery vehicles, multifunctional prodrugs, use as antineoplastic drugs DRUG INNOVATION & DESIGN, INC. 2003-07-24 US disclosed
EP-1255567-A1 SELECTIVE CELLULAR TARGETING: MULTIFUNCTIONAL DELIVERY VEHICLES Drug Innovation & Design, Inc. (US) 2002-11-13 EP disclosed
WO-2001036003-A2 SELECTIVE CELLULAR TARGETING: MULTIFUNCTIONAL DELIVERY VEHICLES DRUG INNOVATION & DESIGN, INC. (US) 2001-05-25 WO 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-20030138432-A1 Selective cellular targeting: multifunctional delivery vehicles, multifunctional prodrugs, use as antineoplastic drugs PAICS, ABCB1, ABCG2 FBP1 1683/4885UMPS 306/4885DNPH1 210/4885

“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.