SCHEMBL1420481

SCHEMBL1420481

CCOC(=O)CCCCc1c[nH]c2c(C(=N)NO)cccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
CYP4F2 P78329 1/20 0.48
CYP4A11 Q02928 1/20 0.48
HTT P42858 2/20 0.46
MPO P05164 2/20 0.45
CLEC4M Q9H2X3 1/20 0.43
ALDH1A1 P00352 4/20 0.43
MAPT P10636 4/20 0.43
KDM4E B2RXH2 2/20 0.43
HPGD P15428 2/20 0.43
LMNA P02545 1/20 0.43
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41

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
SCHEMBL1420103 0.93 SMN1; SMN2 (0.51) SMN1; SMN2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL1420923 0.82 HTT (0.54) SMN1; SMN2HTTMPOCLEC4MALDH1A1
SCHEMBL10300666 0.81 SMN1; SMN2 (0.55) SMN1; SMN2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL597473 0.79 SMN1; SMN2 (0.66) SMN1; SMN2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL1420944 0.77 HTT (0.46) SMN1; SMN2CYP1A2CYP2D6CYP2C19HTT
SCHEMBL1420670 0.76 SMN1; SMN2 (0.42) SMN1; SMN2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL1420616 0.76 SMN1; SMN2 (0.40) SMN1; SMN2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL7399266 0.75 SMN1; SMN2 (0.92) SMN1; SMN2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL2133804 0.75 CYP4F2 (0.47) SMN1; SMN2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL1420320 0.74 CYP4F2 (0.38) SMN1; SMN2CYP1A2CYP3A4CYP2D6CYP2C9

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-8217028-B2 1,2,4-oxadiazole indole compounds GLAXO GROUP LIMITED (GB) 2012-07-10 US disclosed
US-20110086839-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2011-04-14 US disclosed
EP-2297139-A1 COMPOUNDS Glaxo Group Limited (GB) 2011-03-23 EP disclosed
US-20100029729-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-02-04 US disclosed
US-20100010053-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-01-14 US disclosed
WO-2009153307-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-12-23 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-20100029729-A1 COMPOUNDS CYP11B2, CYP11B1, GLS2 SMN1; SMN2 889/4885CYP1A2 18/4885CYP3A4 13/4885
US-20100010053-A1 COMPOUNDS CYP11B2, CYP11B1, GLS2 SMN1; SMN2 889/4885CYP1A2 18/4885CYP3A4 13/4885
US-20110086839-A1 COMPOUNDS CYP11B2, CYP11B1, GLS2 SMN1; SMN2 889/4885CYP1A2 18/4885CYP3A4 13/4885

“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.