SCHEMBL7196945

SCHEMBL7196945

Cc1nc(N=Nc2ccc(S(=O)(=O)O)cc2S(=O)(=O)O)c(COP(=O)(O)O)c(C=O)c1O.[Na].[Na].[Na].[Na]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 1.00
TDP1 Q9NUW8 5/20 1.00
P2RY1 P47900 4/20 1.00
P2RX2 Q9UBL9 3/20 1.00
KDM4E B2RXH2 3/20 1.00
P2RX3 P56373 3/20 1.00
P2RX7 Q99572 3/20 1.00
P2RX5 Q93086 2/20 1.00
P2RX4 Q99571 2/20 1.00
ALDH1A1 P00352 2/20 1.00
CASP1 P29466 1/20 1.00
CYP2C19 P33261 1/20 1.00
RAB9A P51151 1/20 1.00
CASP7 P55210 1/20 1.00
MEN1 O00255 3/20 0.86
KMT2A Q03164 3/20 0.86
HPGD P15428 2/20 0.86
HSD17B10 Q99714 2/20 0.86
ENPP1 P22413 1/20 0.86
P2RY13 Q9BPV8 4/20 0.69

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
SCHEMBL31236767 1.00 MAPT (1.00) MAPTTDP1P2RY1P2RX2KDM4E
SCHEMBL29357199 1.00 MAPT (1.00) MAPTTDP1P2RY1P2RX2KDM4E
SCHEMBL5287746 1.00 MAPT (1.00) MAPTTDP1P2RY1P2RX2KDM4E
SCHEMBL7196930 1.00 MAPT (1.00) MAPTTDP1P2RY1P2RX2KDM4E
SCHEMBL13624677 1.00 MAPT (1.00) MAPTTDP1P2RY1P2RX2KDM4E
Isoppads SCHEMBL29494952 0.93 MAPT (1.00) MAPTTDP1P2RY1P2RX2KDM4E
Isoppads SCHEMBL14702227 0.93 MAPT (1.00) MAPTTDP1P2RY1P2RX2KDM4E
SCHEMBL16450980 0.89 MAPT (0.79) MAPTTDP1P2RY1P2RX2KDM4E
SCHEMBL29374112 0.88 MAPT (0.78) MAPTTDP1P2RY1P2RX2KDM4E
SCHEMBL15354624 0.86 MAPT (0.76) MAPTTDP1P2RY1P2RX2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1328261-A2 TREATMENT OF NEURODEGENERATIVE DISEASE Minerva Biotechnologies Corporation (US) 2003-07-23 EP claimed
US-20030060487-A1 Treatment of neurodegenerative disease MINERVA BIOTECHNOLOGIES CORPORATION 2003-03-27 US claimed
WO-2001078709-A2 TREATMENT OF NEURODEGENERATIVE DISEASE MINERVA BIOTECHNOLOGIES CORPORATION (US) 2001-10-25 WO claimed
US-20030060487-A1 Treatment of neurodegenerative disease MINERVA BIOTECHNOLOGIES CORPORATION 2003-03-27 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-20030060487-A1 Treatment of neurodegenerative disease HTT, IAPP, APP MAPT 9/4885TDP1 76/4885P2RY1 1211/4885

“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.