SCHEMBL17701262

SCHEMBL17701262

[c]1cnc(-c2ncco2)nc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.40
LTA4H P09960 1/20 0.35
BRD4 O60885 1/20 0.31
ADORA2A P29274 2/20 0.31
ADORA1 P30542 2/20 0.31
GLRA3 O75311 1/20 0.30
GLRB P48167 1/20 0.30
CSNK1A1 P48729 1/20 0.30
CSNK1D P48730 1/20 0.30
CSNK1E P49674 1/20 0.30

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
SCHEMBL66901 0.78 HPGDS (0.48) HPGDSLTA4HBRD4ADORA2AADORA1
SCHEMBL4882183 0.74 HPGDS (0.41) HPGDSLTA4HBRD4ADORA2AADORA1
SCHEMBL100765 0.74 HPGDS (0.46) HPGDSLTA4HBRD4ADORA2AADORA1
SCHEMBL13114685 0.71 HPGDS (0.47) HPGDSLTA4HBRD4ADORA2AADORA1
SCHEMBL764108 0.71 HPGDS (0.36) HPGDSLTA4HBRD4
SCHEMBL17701187 0.68 HPGDS (0.37) HPGDSLTA4H
SCHEMBL19475648 0.68 HPGDS (0.37) HPGDSLTA4H
SCHEMBL14211174 0.67 HPGDS (0.43) HPGDSLTA4HBRD4ADORA2AADORA1
SCHEMBL17701235 0.67 HPGDS (0.36) HPGDSLTA4H
SCHEMBL3198079 0.67 HPGDS (0.43) HPGDSLTA4HBRD4GLRA3GLRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160118598-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME JNC CORPORATION (JP) 2016-04-28 US 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-20160118598-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME HVCN1, VDAC1, SLC26A3 HPGDS 4461/4885LTA4H 1673/4885BRD4 712/4885

“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.