SCHEMBL2493672

SCHEMBL2493672

COC(=O)C(=O)Nc1ccc(C2CCC(C(=O)O)CC2)cc1F

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.46
PDE4B Q07343 2/20 0.46
PDE4C Q08493 2/20 0.46
PDE4D Q08499 2/20 0.46
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.41
DGAT1 O75907 4/20 0.41
MAPK14 Q16539 4/20 0.40
SOAT1 P35610 3/20 0.39
HTT P42858 1/20 0.38
BRAF P15056 1/20 0.36
KDR P35968 1/20 0.36
GPR35 Q9HC97 1/20 0.36
DHODH Q02127 4/20 0.36
KLKB1 P03952 1/20 0.36

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
SCHEMBL13247942 0.88 MAPK14 (0.41) NPC1RAB9AKMT2AMAPK14GPR35
SCHEMBL13267945 0.85 MAPK14 (0.39) PDE4APDE4BPDE4CPDE4DNPC1
SCHEMBL2999895 0.85 ALDH1A1 (0.41) NPC1KMT2AMAPK14
SCHEMBL13247973 0.85 MAPK14 (0.38) NPC1KMT2AMAPK14BRAFKDR
SCHEMBL2999891 0.85 ALDH1A1 (0.41) NPC1KMT2AMAPK14
SCHEMBL13247959 0.85 ALDH1A1 (0.41) NPC1KMT2AMAPK14
SCHEMBL2491849 0.84 NPC1 (0.43) PDE4APDE4BPDE4CPDE4DNPC1
SCHEMBL2516499 0.81 CYP17A1 (0.43) PDE4APDE4BPDE4CPDE4DNPC1
SCHEMBL3540920 0.79 NPC1 (0.51) PDE4APDE4BPDE4CPDE4DNPC1
SCHEMBL3540917 0.79 NPC1 (0.51) PDE4APDE4BPDE4CPDE4DNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2379516-A1 1,3,4-OXADIAZOLE DERIVATIVES AND THEIR USES TO TREAT DIABETES AstraZeneca AB (SE) 2011-10-26 EP disclosed
US-20100184813-A1 CHEMICAL COMPOUNDS 553 ASTRAZENECA AB (SE) 2010-07-22 US disclosed
WO-2010070343-A1 1,3,4-OXADIAZOLE DERIVATIVES AND THEIR USES TO TREAT DIABETES ASTRAZENECA AB (SE) 2010-06-24 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-20100184813-A1 CHEMICAL COMPOUNDS 553 GCGR, DGAT1, GPBAR1 PDE4A 2862/4885PDE4B 2132/4885PDE4C 2775/4885

“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.