SCHEMBL1551977

SCHEMBL1551977

CCc1c(-c2nnc(N)o2)ccc(O)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.41
▸ HSD17B10 Q99714 3/20 0.39
▸ NOTUM Q6P988 3/20 0.37
▸ ESR1 P03372 4/20 0.36
▸ ESR2 Q92731 4/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ DGAT1 O75907 1/20 0.35
▸ GSK3B P49841 1/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ EGFR P00533 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL1794969 0.69 NPC1 (0.38) KDM4EHSD17B10NPC1RAB9AKMT2A
SCHEMBL4253508 0.69 NPC1 (0.35) KDM4ENPC1RAB9AALDH1A1GAA
SCHEMBL1551968 0.69 CDC7 (0.52) GSK3B
SCHEMBL28354471 0.68 ESR1 (0.42) KDM4EHSD17B10ESR1ESR2RAB9A
SCHEMBL648577 0.67 ESR1 (0.47) KDM4EHSD17B10ESR1ESR2ALDH1A1
SCHEMBL1513802 0.65 ATM (0.41) KDM4EHSD17B10ESR1ESR2NPC1
SCHEMBL13170400 0.64 RAB9A (0.74) KDM4EHSD17B10NOTUMNPC1RAB9A
SCHEMBL398659 0.64 ATR (0.36) KDM4EHSD17B10NPC1RAB9AALDH1A1
SCHEMBL2321269 0.64 HTR1D (0.46) KDM4EHSD17B10ESR1ESR2ALDH1A1
SCHEMBL16848496 0.63 RAB9A (0.50) KDM4EHSD17B10NOTUMNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2313380-B1 OXADIAZOLE DERIVATIVES FOR TREATING DIABETES MERCK PATENT GMBH (DE) 2013-12-11 — — EP claimed
US-8377975-B2 Oxadiazole derivatives for the treatment of diabetes MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-02-19 — — US claimed
US-20110139654-A1 OXADIAZOLE DERIVATIVES FOR THE TREATMENT OF DIABETES MERCK PATENT GESELLSCHAFT (DE) 2011-06-16 — — US claimed
EP-2313380-B1 OXADIAZOLE DERIVATIVES FOR TREATING DIABETES MERCK PATENT GMBH (DE) 2013-12-11 — — EP disclosed
US-8377975-B2 Oxadiazole derivatives for the treatment of diabetes MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-02-19 — — US disclosed
US-20110139654-A1 OXADIAZOLE DERIVATIVES FOR THE TREATMENT OF DIABETES MERCK PATENT GESELLSCHAFT (DE) 2011-06-16 — — US disclosed
EP-2313380-A1 OXADIAZOLE DERIVATIVES FOR TREATING DIABETES Merck Patent GmbH (DE) 2011-04-27 — — EP disclosed
WO-2010020305-A1 OXADIAZOLE DERIVATIVES FOR TREATING DIABETES MERCK PATENT GMBH (DE) 2010-02-25 — — 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-20110139654-A1 OXADIAZOLE DERIVATIVES FOR THE TREATMENT OF DIABETES PFKL, RXFP3, OXA1L KDM4E 1710/4885HSD17B10 1125/4885NOTUM 3429/4885

“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.

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