SCHEMBL3054572

SCHEMBL3054572

O=P(O)(O)COCCc1nc2ncncc2[nH]1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.34
METAP1 P53582 1/20 0.34
ENPP1 P22413 1/20 0.32
FGFR1 P11362 1/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
TYMP P19971 1/20 0.32
HPRT1 P00492 2/20 0.31
GRIN2B Q13224 1/20 0.30

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
SCHEMBL3417484 0.88 ENPP1 (0.32) METAP2METAP1ENPP1
SCHEMBL3044434 0.87 METAP2 (0.35) METAP2METAP1ENPP1HPRT1GRIN2B
SCHEMBL235437 0.79 CACNA1H (0.41) METAP2METAP1ENPP1GRIN2B
SCHEMBL6485 0.74 METAP2 (0.42) METAP2METAP1ENPP1GRIN2B
SCHEMBL29208955 0.71 METAP2 (0.42) METAP2METAP1ENPP1
SCHEMBL30884953 0.71 METAP2 (0.42) METAP2METAP1ENPP1
SCHEMBL4955472 0.71 METAP2 (0.42) METAP2METAP1ENPP1
SCHEMBL9516035 0.71 METAP2 (0.35) METAP2METAP1ENPP1
SCHEMBL4957389 0.71 METAP2 (0.44) METAP2METAP1ENPP1GRIN2B
SCHEMBL9936013 0.71 METAP2 (0.44) METAP2METAP1ENPP1GRIN2B

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
US-7790905-B2 Pharmaceutical propylene glycol solvate compositions MCNEIL-PPC, INC. (US) 2010-09-07 US disclosed
US-20080300222-A1 Phosphoantigen Salts Of Organic Bases And Methods For Their Crystallization INNATE PHARMA (FR) 2008-12-04 US disclosed
EP-1933848-A2 PHOSPHOANTIGEN SALTS OF ORGANIC BASES AND METHODS FOR THEIR CRYSTALLIZATION Innate Pharma (FR) 2008-06-25 EP disclosed
WO-2007039635-A2 PHOSPHOANTIGEN SALTS OF ORGANIC BASES AND METHODS FOR THEIR CRYSTALLIZATION INNATE PHARMA (FR) 2007-04-12 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-20080300222-A1 Phosphoantigen Salts Of Organic Bases And Methods For Their Crystallization HLA-B, LCK, HLA-A METAP2 2424/4885METAP1 2269/4885ENPP1 370/4885

“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.