SCHEMBL25837760

SCHEMBL25837760

CCOC(=O)C(=O)NNC(=O)c1cccc(C)c1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.62
CYP2C19 P33261 2/20 0.59
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
MAPT P10636 3/20 0.55
POLB P06746 1/20 0.55
CTDSP1 Q9GZU7 1/20 0.55
RAB9A P51151 3/20 0.54
NPC1 O15118 2/20 0.54
GAA P10253 2/20 0.53
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
ALDH1A1 P00352 3/20 0.52
HTT P42858 2/20 0.50
TAS1R3 Q7RTX0 1/20 0.50
TAS1R1 Q7RTX1 1/20 0.50
KDM4E B2RXH2 1/20 0.50

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
SCHEMBL30046308 0.86 NPC1 (0.59) SMN1; SMN2CYP2C19KMT2AMEN1MAPT
SCHEMBL18974104 0.86 NPC1 (0.59) SMN1; SMN2CYP2C19KMT2AMEN1MAPT
SCHEMBL18974108 0.86 KMT2A (0.56) SMN1; SMN2KMT2AMEN1MAPTRAB9A
SCHEMBL11479178 0.84 GAA (0.51) SMN1; SMN2MAPTRAB9ANPC1GAA
SCHEMBL1222782 0.84 SMN1; SMN2 (0.57) SMN1; SMN2MAPTRAB9ANPC1GAA
SCHEMBL24073601 0.82 HDAC3 (0.58) SMN1; SMN2KMT2AMEN1MAPTPOLB
SCHEMBL29470218 0.82 PDCD1 (0.51) GAAALDH1A1
SCHEMBL18987060 0.82 PDCD1 (0.51) GAAALDH1A1
SCHEMBL24931248 0.82 SMN1; SMN2 (0.89) SMN1; SMN2CYP2C19KMT2AMEN1MAPT
SCHEMBL321802 0.81 GAA (0.64) SMN1; SMN2KMT2AMEN1RAB9ANPC1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219939-A1 N-(1-CYANO-PYRROLIDIN-3-YL)-5-(3-(TRIFLUOROMETHYL)PHENYL)OXAZOLE-2-CARBOXAMIDE DERIVATIVES AND THE CORRESPONDING OXADIAZOLE DERIVATIVES AS USP30 INHIBITORS FOR THE TREATMENT OF MITOCHONDRIAL DYSFUNCTION MISSION THERAPEUTICS LIMITED (GB) 2023-07-13 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 (1 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-20230219939-A1 N-(1-CYANO-PYRROLIDIN-3-YL)-5-(3-(TRIFLUOROMETHYL)PHENYL)OXAZOLE-2-CARBOXAMIDE DERIVATIVES AND THE CORRESPONDING OXADIAZOLE DERIVATIVES AS USP30 INHIBITORS FOR THE TREATMENT OF MITOCHONDRIAL DYSFUNCTION USP30, UQCRC1, NDUFAF1 SMN1; SMN2 2324/4885CYP2C19 3996/4885KMT2A 3440/4885

“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.