SCHEMBL5744116

SCHEMBL5744116

OCc1nc2c(F)cccc2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 1/20 0.42
▸ POLB P06746 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ MGAM O43451 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ SI P14410 1/20 0.40
▸ MGAM2 Q2M2H8 1/20 0.40
▸ SLC40A1 Q9NP59 5/20 0.39
▸ DHODH Q02127 2/20 0.39
▸ PARP1 P09874 1/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ CHEK1 O14757 1/20 0.38
▸ GRIN1 Q05586 1/20 0.38
▸ GRIN2B Q13224 1/20 0.38

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
SCHEMBL4270442 0.82 EGLN1 (0.42) EGLN1POLBTDP1MGAMGAA
SCHEMBL17308357 0.82 DDAH1 (0.53) EGLN1POLBMGAMGAASI
SCHEMBL4061481 0.82 MGAM (0.40) EGLN1POLBMGAMGAASI
Hydrochloric Acid SCHEMBL23497492 0.81 EGLN1 (0.41) EGLN1POLBTDP1MGAMGAA
Hydrochloric Acid SCHEMBL23782097 0.81 EGLN1 (0.41) EGLN1POLBTDP1MGAMGAA
SCHEMBL9533100 0.80 GRIN1 (0.55) TDP1MGAMGAASIMGAM2
Hydrochloric Acid SCHEMBL23497490 0.79 EGLN1 (0.40) EGLN1POLBMGAMGAASI
SCHEMBL22075724 0.79 SLC40A1 (0.40) EGLN1POLBMGAMGAASI
SCHEMBL3938941 0.79 CHEK1 (0.57) POLBTDP1GAAPARP1RAB9A
SCHEMBL4346855 0.79 MGAM (0.51) TDP1MGAMGAASIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578743-A4 ANTIBACTERIAL AGENTS GLAXO GROUP LTD (GB) 2006-11-29 — — EP disclosed
US-20060041123-A1 Antibacterial agents GLAXO GROUP LIMITED (GB) 2006-02-23 — — US disclosed
EP-1578743-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2005-09-28 — — EP disclosed
WO-2004058144-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2004-07-15 — — 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-20060041123-A1 Antibacterial agents NQO2, NRDC, IFNG EGLN1 2033/4885POLB 301/4885TDP1 2671/4885

“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