SCHEMBL19079328

SCHEMBL19079328

N[C@@H](CO)C(=O)N1CCC(C(NC(=O)c2cc(C3CC3)on2)c2ccccc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SMYD3 Q9H7B4 17/20 0.61
▸ MEN1 O00255 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ SGPL1 O95470 1/20 0.45

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
SCHEMBL19064440 0.89 SMYD3 (0.55) SMYD3MEN1TP53KMT2ASMN1; SMN2
SCHEMBL19079293 0.89 SMYD3 (0.55) SMYD3MEN1TP53KMT2ASMN1; SMN2
SCHEMBL21932514 0.89 SMYD3 (0.55) SMYD3MEN1TP53KMT2ASMN1; SMN2
SCHEMBL17594572 0.89 SMYD3 (0.55) SMYD3MEN1TP53KMT2ASMN1; SMN2
SCHEMBL17594575 0.89 SMYD3 (0.55) SMYD3MEN1TP53KMT2ASMN1; SMN2
SCHEMBL19079342 0.89 SMYD3 (0.55) SMYD3MEN1TP53KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL17594832 0.88 SMYD3 (0.54) SMYD3MEN1TP53KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL21932012 0.88 SMYD3 (0.54) SMYD3MEN1TP53KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL17594427 0.88 SMYD3 (0.54) SMYD3MEN1TP53KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL19064666 0.88 SMYD3 (0.54) SMYD3MEN1TP53KMT2ASMN1; SMN2

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-20200148650-A1 ISOXAZOLE CARBOXAMIDE COMPOUNDS Epizyme, Inc. 2020-05-14 — — US disclosed
US-10428029-B2 Isoxazole carboxamide compounds Epizyme, Inc. (US) 2019-10-01 — — US disclosed
US-20170190676-A1 Isoxazole Carboxamide Compounds Epizyme, Inc. (US) 2017-07-06 — — US disclosed
US-20170190676-A1 Isoxazole Carboxamide Compounds Epizyme, Inc. (US) 2017-07-06 — — 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 (3 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-10428029-B2 Isoxazole carboxamide compounds SMYD3, SMYD2, SNRPD3 SMYD3 1/4885MEN1 3284/4885TP53 507/4885
US-20170190676-A1 Isoxazole Carboxamide Compounds SMYD3, SMYD2, SNRPD3 SMYD3 1/4885MEN1 3284/4885TP53 507/4885
US-20200148650-A1 ISOXAZOLE CARBOXAMIDE COMPOUNDS SMYD3, SMYD2, SNRPD3 SMYD3 1/4885MEN1 3153/4885TP53 538/4885

“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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