SCHEMBL19079243

SCHEMBL19079243

CCCc1cc(C(=O)N[C@H]2CC[C@H](N)CC2)no1

nearest known ligand 0.79

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.79
NPC1 O15118 5/20 0.79
SMN1; SMN2 Q16637 4/20 0.79
ALDH1A1 P00352 1/20 0.77
SMYD3 Q9H7B4 11/20 0.57
HPGD P15428 1/20 0.52
S1PR1 P21453 1/20 0.49
S1PR3 Q99500 1/20 0.49
POLB P06746 1/20 0.49

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
SCHEMBL19079255 0.93 NPC1 (0.67) RAB9ANPC1SMN1; SMN2ALDH1A1SMYD3
SCHEMBL19079161 0.88 NPC1 (0.61) RAB9ANPC1SMN1; SMN2ALDH1A1SMYD3
Hydrochloric Acid SCHEMBL19064420 0.87 NPC1 (0.60) RAB9ANPC1SMN1; SMN2ALDH1A1SMYD3
Hydrochloric Acid SCHEMBL19064418 0.87 NPC1 (0.60) RAB9ANPC1SMN1; SMN2ALDH1A1SMYD3
SCHEMBL19079173 0.86 NPC1 (0.58) RAB9ANPC1SMN1; SMN2ALDH1A1SMYD3
SCHEMBL19079242 0.84 NPC1 (0.55) RAB9ANPC1SMN1; SMN2ALDH1A1SMYD3
SCHEMBL19079406 0.80 SMYD3 (0.60) RAB9ANPC1SMN1; SMN2SMYD3
SCHEMBL19079178 0.79 SMN1; SMN2 (0.74) RAB9ANPC1SMN1; SMN2SMYD3
SCHEMBL19064427 0.76 NPC1 (0.62) RAB9ANPC1SMN1; SMN2ALDH1A1SMYD3
SCHEMBL19064423 0.76 NPC1 (0.62) RAB9ANPC1SMN1; SMN2ALDH1A1SMYD3

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 RAB9A 759/4885NPC1 3888/4885SMN1; SMN2 248/4885
US-20170190676-A1 Isoxazole Carboxamide Compounds SMYD3, SMYD2, SNRPD3 RAB9A 759/4885NPC1 3888/4885SMN1; SMN2 248/4885
US-20200148650-A1 ISOXAZOLE CARBOXAMIDE COMPOUNDS SMYD3, SMYD2, SNRPD3 RAB9A 705/4885NPC1 3842/4885SMN1; SMN2 223/4885

“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.