SCHEMBL6047384

SCHEMBL6047384

CCCNC(=O)c1cc2nc(-c3ccco3)nn2c(N)n1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
TP53 P04637 1/20 0.54
GAA P10253 1/20 0.54
HPGD P15428 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
ADORA2A P29274 5/20 0.53
ADORA3 P0DMS8 2/20 0.51
ADORA2B P29275 2/20 0.51
ADORA1 P30542 2/20 0.51
F2 P00734 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL6047211 0.92 ADORA2A (0.55) ALDH1A1ADORA2AADORA3ADORA2BADORA1
SCHEMBL6047319 0.85 ADORA2A (0.60) NPC1ALDH1A1RAB9ASMN1; SMN2ADORA2A
SCHEMBL6047294 0.85 ADORA2A (0.55) NPC1RAB9AADORA2AADORA3ADORA2B
SCHEMBL6047383 0.83 KDM4E (0.56) NPC1ALDH1A1HPGDRAB9AADORA2A
SCHEMBL6047187 0.82 ADORA2A (0.61) ADORA2A
SCHEMBL6047201 0.82 ADORA2A (0.50) ADORA2AADORA3ADORA2BADORA1
SCHEMBL6047175 0.81 ADORA2A (0.66) ADORA2A
SCHEMBL6047332 0.81 ADORA2A (0.64) NPC1ALDH1A1HPGDADORA2AADORA3
SCHEMBL6047304 0.80 ADORA2A (0.58) ADORA2A
SCHEMBL6870605 0.79 ADORA2A (0.58) ALDH1A1HPGDADORA2AADORA3ADORA2B

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 NPC1 1940/4885ALDH1A1 360/4885LMNA 4026/4885

“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.