SCHEMBL17594367

SCHEMBL17594367

CCCCNC(=O)c1ccon1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.60
SMN1; SMN2 Q16637 5/20 0.52
NPC1 O15118 4/20 0.52
RAB9A P51151 4/20 0.52
LMNA P02545 3/20 0.52
TP53 P04637 3/20 0.52
HTT P42858 2/20 0.52
HIF1A Q16665 1/20 0.52
TSHR P16473 1/20 0.51
HPGD P15428 3/20 0.50
KMT2A Q03164 2/20 0.50
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
NAAA Q02083 2/20 0.45
GAA P10253 1/20 0.45
MEN1 O00255 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL19064377 0.90 RAB9A (0.54) ATMSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL656888 0.83 ATM (0.43) ATMSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL15704535 0.80 MAOB (0.51) ATMSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL13072251 0.79 POLB (0.46) SMN1; SMN2LMNAHTTHPGDALDH1A1
SCHEMBL892942 0.79 ATM (0.40) ATMSMN1; SMN2NPC1RAB9ALMNA
Phosphoric Acid SCHEMBL4435975 0.79 CNR1 (0.41) ATMSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL893060 0.78 CHRNA4 (0.41) ATMSMN1; SMN2HIF1AALDH1A1GAA
SCHEMBL892675 0.76 ACACB (0.44) ATMSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL893320 0.76 ACACB (0.39) ATMSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL3940897 0.76 CHRNA4 (0.40) ATMSMN1; SMN2ALDH1A1GAAL3MBTL1

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-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
EP-3193603-A1 ISOXAZOLE CARBOXAMIDE COMPOUNDS Epizyme, Inc. (US) 2017-07-26 EP disclosed
US-20170190676-A1 Isoxazole Carboxamide Compounds Epizyme, Inc. (US) 2017-07-06 US disclosed
WO-2016040498-A1 ISOXAZOLE CARBOXAMIDE COMPOUNDS Epizyme, Inc. (US) 2016-03-17 WO 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 ATM 1643/4885SMN1; SMN2 248/4885NPC1 3888/4885
US-20170190676-A1 Isoxazole Carboxamide Compounds SMYD3, SMYD2, SNRPD3 ATM 1643/4885SMN1; SMN2 248/4885NPC1 3888/4885
US-20200148650-A1 ISOXAZOLE CARBOXAMIDE COMPOUNDS SMYD3, SMYD2, SNRPD3 ATM 1704/4885SMN1; SMN2 223/4885NPC1 3842/4885

“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.