SCHEMBL19079178

SCHEMBL19079178

CC(C)c1cc(C(=O)N[C@H]2CC[C@H](N)CC2)no1

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.74
NPC1 O15118 1/20 0.74
TSHR P16473 1/20 0.74
RAB9A P51151 1/20 0.74
SMYD3 Q9H7B4 18/20 0.66

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
SCHEMBL19079287 0.87 SMYD3 (0.57) SMN1; SMN2NPC1TSHRRAB9ASMYD3
SCHEMBL19079406 0.84 SMYD3 (0.60) SMN1; SMN2NPC1TSHRRAB9ASMYD3
SCHEMBL19079242 0.83 NPC1 (0.55) SMN1; SMN2NPC1TSHRRAB9ASMYD3
SCHEMBL19728051 0.81 SMYD3 (1.00) SMN1; SMN2NPC1TSHRRAB9ASMYD3
SCHEMBL19715201 0.80 SMYD3 (0.85) NPC1RAB9ASMYD3
SCHEMBL19715203 0.80 SMYD3 (0.85) NPC1RAB9ASMYD3
Hydrochloric Acid SCHEMBL19715178 0.79 SMYD3 (0.83) NPC1RAB9ASMYD3
Hydrochloric Acid SCHEMBL19715177 0.79 SMYD3 (0.83) NPC1RAB9ASMYD3
SCHEMBL19079243 0.79 RAB9A (0.79) SMN1; SMN2NPC1RAB9ASMYD3
SCHEMBL19079163 0.78 SMYD3 (0.56) SMN1; SMN2NPC1TSHRRAB9ASMYD3

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 SMN1; SMN2 248/4885NPC1 3888/4885TSHR 3559/4885
US-20170190676-A1 Isoxazole Carboxamide Compounds SMYD3, SMYD2, SNRPD3 SMN1; SMN2 248/4885NPC1 3888/4885TSHR 3559/4885
US-20200148650-A1 ISOXAZOLE CARBOXAMIDE COMPOUNDS SMYD3, SMYD2, SNRPD3 SMN1; SMN2 223/4885NPC1 3842/4885TSHR 3513/4885

“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.