SCHEMBL15875368

SCHEMBL15875368

O=CCCc1nn(-c2ccc3c(c2)OCCO3)c(=O)o1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 1/20 0.40
▸ RAB9A P51151 4/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ BRD9 Q9H8M2 3/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CYP11B2 P19099 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ CMA1 P23946 1/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ GRK2 P25098 1/20 0.35
▸ CTDSP1 Q9GZU7 1/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ PTGS2 P35354 1/20 0.35
▸ BRD7 Q9NPI1 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ NFKB2 Q00653 1/20 0.35

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
SCHEMBL17311925 0.84 NOTUM (0.44) NOTUMRAB9ANPC1BRD9L3MBTL1
SCHEMBL15875778 0.79 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2KMT2ADRD2DRD4
SCHEMBL17311878 0.76 MAOA (0.43) NOTUMRAB9ANPC1L3MBTL1ALDH1A1
SCHEMBL15875143 0.75 NPC1 (0.42) NOTUMRAB9ANPC1CYP11B2ALDH1A1
SCHEMBL15875582 0.71 HTT (0.39) RAB9ANPC1ALDH1A1KMT2ALMNA
SCHEMBL15875491 0.71 ABHD16A (0.35) ALDH1A1PTGS2
SCHEMBL15875638 0.71 MGLL (0.41) ALDH1A1KDM4ELMNA
SCHEMBL6061509 0.69 TAAR1 (0.47) RAB9ANPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL17311882 0.68 NR3C2 (0.43) —
SCHEMBL23857027 0.66 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2KMT2ADRD2DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9487516-B2 Antibacterial oxadiazolone derivatives ACTELION PHARMACEUTICALS, LTD. (CH) 2016-11-08 — — US disclosed
US-20150353547-A1 Antibacterial Oxadiazolone Derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2015-12-10 — — US disclosed
EP-2943492-A1 ANTIBACTERIAL OXADIAZOLONE DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2015-11-18 — — EP disclosed
EP-2943227-A1 TRIAZINE BASED RADIOPHARMACEUTICALS AND RADIOIMAGING AGENTS Molecular Insight Pharmaceuticals (US) 2015-11-18 — — EP disclosed
WO-2014110372-A1 TRIAZINE BASED RADIOPHARMACEUTICALS AND RADIOIMAGING AGENTS MOLECULAR INSIGHT PHARMACEUTICALS (US) 2014-07-17 — — WO disclosed
WO-2014108836-A1 ANTIBACTERIAL OXADIAZOLONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2014-07-17 — — 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 (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-20150353547-A1 Antibacterial Oxadiazolone Derivatives OXA1L, PYM1, XDH NOTUM 3259/4885RAB9A 3069/4885NPC1 2275/4885

“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.

Send feedback