SCHEMBL9344786

SCHEMBL9344786

CCOC(=O)C(N)Cc1cc(CP(=O)(OCC)OCC)cc(-c2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ SCN9A Q15858 1/20 0.41
▸ MAPK1 P28482 2/20 0.39
▸ HPRT1 P00492 1/20 0.39
▸ MAPT P10636 2/20 0.39

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
SCHEMBL9343956 0.89 TDP1 (0.40) MEN1KMT2AALOX15CYP2C19HSD17B10
SCHEMBL9345135 0.88 MEN1 (0.56) MEN1KMT2AALOX15CYP2C19HSD17B10
SCHEMBL9348521 0.81 MEN1 (0.39) MEN1KMT2AALOX15CYP2C19HSD17B10
SCHEMBL9348882 0.81 MEN1 (0.41) MEN1KMT2AALOX15CYP2C19HSD17B10
SCHEMBL9348888 0.81 MEN1 (0.41) MEN1KMT2AALOX15CYP2C19HSD17B10
SCHEMBL9345597 0.81 MEN1 (0.50) MEN1KMT2AALOX15CYP2C19HSD17B10
SCHEMBL9345173 0.79 KMT2A (0.40) MEN1KMT2AALOX15CYP2C19HSD17B10
Acetic Acid SCHEMBL27782836 0.76 SRR (0.51) SCN9A
Hydrochloric Acid SCHEMBL27782844 0.76 SRR (0.54) SCN9A
SCHEMBL132790 0.74 ALPI (0.61) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200163916-A1 PROBENECID FOR USE IN TREATING EPILEPTIC DISEASES, DISORDERS OR CONDITIONS PARIS SCIENCES ET LETTRES - QUARTIER LATIN (FR) 2020-05-28 — — US disclosed
EP-3651758-A1 PROBENECID FOR USE IN TREATING EPILEPTIC DISEASES, DISORDERS OR CONDITIONS Paris Sciences et Lettres - Quartier Latin (FR) 2020-05-20 — — EP disclosed
WO-2019012109-A1 PROBENECID FOR USE IN TREATING EPILEPTIC DISEASES, DISORDERS OR CONDITIONS PARIS SCIENCES ET LETTRES - QUARTIER LATIN (FR) 2019-01-17 — — WO disclosed
US-5321016-A Epliepsy, central nervous system disorders SANDOZ PHARMACEUTICALS CORP. (US) 1994-06-14 — — US disclosed
US-5162311-A Treating epilepsy, psychiatric disorders SANDOZ PHARMACEUTICALS CORP. (US) 1992-11-10 — — 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-20200163916-A1 PROBENECID FOR USE IN TREATING EPILEPTIC DISEASES, DISORDERS OR CONDITIONS NLN, CLN6, SLC1A2 MEN1 1615/4885KMT2A 2257/4885ALOX15 1542/4885

“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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