SCHEMBL16639432

SCHEMBL16639432

CC(=O)[C@H]1OC(C)(C)O[C@H]1C

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
GAA P10253 1/20 0.31
PGD P52209 1/20 0.31

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
SCHEMBL16488404 1.00 MAPK1 (0.37) MAPK1NPSR1GAAPGD
SCHEMBL14944925 1.00 MAPK1 (0.37) MAPK1NPSR1GAAPGD
SCHEMBL14944924 1.00 MAPK1 (0.37) MAPK1NPSR1GAAPGD
SCHEMBL7554691 0.85 MAPK1 (0.42) MAPK1NPSR1GAAPGD
SCHEMBL682098 0.85 MAPK1 (0.42) MAPK1NPSR1GAAPGD
SCHEMBL7551362 0.85 MAPK1 (0.42) MAPK1NPSR1GAAPGD
SCHEMBL12638787 0.85 MAPK1 (0.42) MAPK1NPSR1GAAPGD
SCHEMBL4243891 0.81 SUCNR1 (0.38) MAPK1NPSR1GAAPGD
SCHEMBL15325118 0.81 SUCNR1 (0.38) MAPK1NPSR1GAAPGD
SCHEMBL14527074 0.81 SUCNR1 (0.38) MAPK1NPSR1GAAPGD

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-9365573-B2 Method for synthesizing sapropterin dihydrochloride ASYMCHEM LABORATORIES (TIANJIN) CO., LTD (CN) 2016-06-14 US disclosed
US-20150105555-A1 METHOD FOR SYNTHESIZING SAPROPTERIN DIHYDROCHLORIDE TIANJIN ASYMCHEM PHARMACEUTICAL CO., LTD (CN) 2015-04-16 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-20150105555-A1 METHOD FOR SYNTHESIZING SAPROPTERIN DIHYDROCHLORIDE CYP51A1, DHCR7, LSS MAPK1 3539/4885NPSR1 1105/4885GAA 3185/4885

“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.