SCHEMBL3446205

SCHEMBL3446205

COC(=O)CCC(NC(=O)c1ccc(NCC2CNc3nc(N)[nH]c(=O)c3N2)cc1)C(=O)OC

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SOST Q9BQB4 1/20 0.75
▸ FPGS Q05932 2/20 0.74
▸ GART P22102 4/20 0.56
▸ DHFR P00374 1/20 0.51
▸ LMNA P02545 1/20 0.49
▸ MTHFD1 P11586 1/20 0.49
▸ ATIC P31939 4/20 0.49
▸ NOS1 P29475 2/20 0.48
▸ NOS3 P29474 1/20 0.48
▸ NOS2 P35228 1/20 0.48

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
SCHEMBL7077904 0.94 SOST (0.85) SOSTFPGSGARTDHFRLMNA
SCHEMBL133543 0.94 SOST (0.85) SOSTFPGSGARTDHFRLMNA
SCHEMBL20509041 0.94 SOST (0.85) SOSTFPGSGARTDHFRLMNA
SCHEMBL10464162 0.94 SOST (0.85) SOSTFPGSGARTDHFRLMNA
SCHEMBL7076983 0.94 SOST (0.85) SOSTFPGSGARTDHFRLMNA
SCHEMBL27903149 0.94 SOST (0.85) SOSTFPGSGARTDHFRLMNA
SCHEMBL28206347 0.93 SOST (0.84) SOSTFPGSGARTDHFRLMNA
SCHEMBL27284124 0.93 SOST (0.84) SOSTFPGSGARTDHFRLMNA
SCHEMBL4613239 0.93 SOST (0.67) SOSTFPGSGARTDHFRLMNA
Phosphoric Acid SCHEMBL28313723 0.92 SOST (0.82) SOSTFPGSGARTDHFRLMNA

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-7816525-B1 Process for the preparation of optically pure tetrahydropterins and derivatives, and specifically of optically pure tetrahydrofolic acid and derivatives thereof, by stereospecific hydrogenation Merck & Cie (CH) 2010-10-19 — — US disclosed
US-20080306263-A1 Process For The Preparation Of Optically Pure Tetrahydropterins And Derivatives, And Specifically Of Optically Pure Tetrahydrofolic Acid And Derivatives Thereof, By Stereospecific Hydrogenation MULLER HANS RUDOLF 2008-12-11 — — 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-20080306263-A1 Process For The Preparation Of Optically Pure Tetrahydropterins And Derivatives, And Specifically Of Optically Pure Tetrahydrofolic Acid And Derivatives Thereof, By Stereospecific Hydrogenation DHFR, MTHFD2, MTHFD1 SOST 2497/4885FPGS 12/4885GART 152/4885

“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.

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