SCHEMBL13935070

SCHEMBL13935070

CN(CC(=O)Nc1ccc(-c2cocn2)cc1)C(=O)C1CCS(=O)(=O)CC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ KMT2A Q03164 3/20 0.38
▸ GAA P10253 1/20 0.37
▸ GPR119 Q8TDV5 1/20 0.36
▸ NCOA3 Q9Y6Q9 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ TAAR1 Q96RJ0 1/20 0.34
▸ HDAC4 P56524 1/20 0.34

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
SCHEMBL2236768 0.85 GAA (0.36) L3MBTL1KMT2AGAAMEN1
SCHEMBL2238051 0.85 HDAC1 (0.37) L3MBTL1KMT2AGAAMEN1HDAC4
SCHEMBL2238684 0.85 CHRM1 (0.36) L3MBTL1HDAC4
SCHEMBL2240153 0.83 ALDH1A1 (0.39) L3MBTL1KMT2AGAAMEN1
SCHEMBL2239265 0.82 HDAC1 (0.39) KMT2AMEN1
SCHEMBL2236534 0.82 HDAC1 (0.38) L3MBTL1NCOA3
SCHEMBL2238884 0.82 POLB (0.36) L3MBTL1KMT2AGAA
SCHEMBL13935076 0.82 L3MBTL1 (0.40) L3MBTL1KMT2AGAAGPR119NCOA3
SCHEMBL2234755 0.81 HDAC1 (0.35) L3MBTL1
SCHEMBL2236865 0.81 HDAC1 (0.37) L3MBTL1

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-20090042915-A1 PREVENTIVE OR THERAPEUTIC AGENT FOR HERPESVIRUS-RELEATED DISEASE ASTELLAS PHARMA INC. (JP) 2009-02-12 — — US disclosed
US-20090030049-A1 MEDICAMENT FOR GENITAL HERPES ASTELLAS PHARMA INC. (JP) 2009-01-29 — — 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 (2 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-20090042915-A1 PREVENTIVE OR THERAPEUTIC AGENT FOR HERPESVIRUS-RELEATED DISEASE RECQL, DNA2, DHX35 L3MBTL1 1740/4885KMT2A 1021/4885GAA 272/4885
US-20090030049-A1 MEDICAMENT FOR GENITAL HERPES TK1, TYMP, RPL23 L3MBTL1 3792/4885KMT2A 1065/4885GAA 1262/4885

“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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