SCHEMBL6047302

SCHEMBL6047302

Nc1nc(C(=O)N2CCC(Cc3ccccc3)CC2)cc2nc(-c3ccco3)nn12

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 6/20 0.52
ADORA1 P30542 2/20 0.49
SCD O00767 1/20 0.48
SCD5 Q86SK9 1/20 0.48
MGLL Q99685 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46

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
SCHEMBL6047247 0.88 ADORA2A (0.54) ADORA2AADORA1
SCHEMBL6047236 0.86 ADORA2A (0.58) ADORA2AADORA1
SCHEMBL6047219 0.85 ADORA2A (0.57) ADORA2AADORA1KDM4EALDH1A1LMNA
SCHEMBL6047235 0.84 ADORA2A (0.56) ADORA2AADORA1
SCHEMBL6047365 0.84 ADORA2A (0.72) ADORA2AADORA1KDM4EALDH1A1LMNA
SCHEMBL6047398 0.83 ADORA2A (0.52) ADORA2AADORA1KDM4EALDH1A1LMNA
SCHEMBL6047293 0.83 ADORA2A (0.72) ADORA2AADORA1KDM4EALDH1A1LMNA
SCHEMBL6047220 0.83 ADORA2A (0.72) ADORA2AADORA1KDM4EALDH1A1LMNA
SCHEMBL6047388 0.83 ADORA2A (0.55) ADORA2AADORA1
SCHEMBL6047262 0.82 ADORA2A (0.60) ADORA2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060058320-A1 [1,2,4] Triazolo[1,5-c]pyrimidine derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-03-16 US disclosed
EP-1544200-A1 1,2,4 -TRIAZOLO 1,5-c PYRIMIDINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2005-06-22 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-20060058320-A1 [1,2,4] Triazolo[1,5-c]pyrimidine derivatives ADORA2A, ADORA1, ADORA3 ADORA2A 1/4885ADORA1 2/4885SCD 2885/4885

“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.