SCHEMBL7807032

SCHEMBL7807032

OCc1nc2cc(Oc3ccncc3)ccc2[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
GRIN1 Q05586 7/20 0.42
GRIN2B Q13224 7/20 0.42
RHEB Q15382 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
KDR P35968 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 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
Hydrochloric Acid SCHEMBL8480108 0.99 TDP1 (0.42) TDP1GRIN1GRIN2BRHEBNPSR1
SCHEMBL7807037 0.89 TDP1 (0.54) TDP1GRIN1GRIN2BRHEBNPSR1
Hydrochloric Acid SCHEMBL8480113 0.87 TDP1 (0.52) TDP1GRIN1GRIN2BRHEBNPSR1
SCHEMBL7806900 0.87 GRIN1 (0.56) TDP1GRIN1GRIN2BRHEBNPSR1
SCHEMBL7811234 0.87 GRIN1 (0.49) TDP1GRIN1GRIN2BRHEBNPSR1
SCHEMBL7813889 0.86 GRIN1 (0.42) TDP1GRIN1GRIN2BTSHRHSD17B10
Hydrochloric Acid SCHEMBL8476973 0.84 GRIN1 (0.41) TDP1GRIN1GRIN2BTSHRHSD17B10
Hydrochloric Acid SCHEMBL8478920 0.84 GRIN1 (0.47) TDP1GRIN1GRIN2BRHEBNPSR1
SCHEMBL7806830 0.84 TDP1 (0.49) TDP1GRIN1GRIN2BRHEBNPC1
Hydrochloric Acid SCHEMBL8524865 0.83 TDP1 (0.48) TDP1GRIN1GRIN2BRHEBNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0820990-B1 Benzimidazole, benzoxazole, and benzothiazole derivatives useful as interleukin 1beta inhibitors ADIR (FR) 2001-01-17 EP claimed
EP-0820990-A2 Novel benzimidazole, benzoxazole, and benzothiazole derivatives useful as interleukin 1beta inhibitors ADIR ET COMPAGNIE (FR) 1998-01-28 EP claimed
JP-10067753-A None JP disclosed
US-20110104186-A1 Small molecule immunopotentiators and assays for their detection NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2011-05-05 US disclosed
US-20110104186-A1 Small molecule immunopotentiators and assays for their detection NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2011-05-05 US disclosed
EP-0820990-B1 Benzimidazole, benzoxazole, and benzothiazole derivatives useful as interleukin 1beta inhibitors ADIR (FR) 2001-01-17 EP disclosed
US-5972968-A INTERLEUKIN INHIBITOR ADIR ET COMPAGNIE (FR) 1999-10-26 US disclosed
JP-H1067753-A NEW BENZIMIDAZOLE, BENZOXAZOLE AND BENZOTHIAZOLE COMPOUNDS, THEIR PRODUCTION AND MEDICINE COMPRISING THE SAME ADIR 1998-03-10 JP disclosed
EP-0820990-A2 Novel benzimidazole, benzoxazole, and benzothiazole derivatives useful as interleukin 1beta inhibitors ADIR ET COMPAGNIE (FR) 1998-01-28 EP 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-20110104186-A1 Small molecule immunopotentiators and assays for their detection ICOS, CD14, MAVS TDP1 4293/4885GRIN1 4459/4885GRIN2B 4453/4885

“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.