SCHEMBL6047291

SCHEMBL6047291

O=CN1CCCCC1c1ccc(O)cc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 5/20 0.42
ESR1 P03372 1/20 0.42
LMNA P02545 1/20 0.38
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MIF P14174 2/20 0.35
DEGS1 O15121 1/20 0.34

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
SCHEMBL27852341 0.83 TRPA1 (0.48) LMNA
SCHEMBL8846952 0.83 CHRNB2 (0.49) MEN1KMT2A
SCHEMBL8846954 0.83 CHRNB2 (0.49) MEN1KMT2A
SCHEMBL4019471 0.83 CHRNB2 (0.49) MEN1KMT2A
SCHEMBL8540221 0.82 TRPA1 (0.47) LMNAMEN1KMT2A
SCHEMBL8540223 0.82 TRPA1 (0.47) LMNAMEN1KMT2A
SCHEMBL22754932 0.81 OPRM1 (0.41)
SCHEMBL8540149 0.81 CHRNB2 (0.47) MEN1KMT2A
SCHEMBL8540152 0.81 CHRNB2 (0.47) MEN1KMT2A
SCHEMBL8542500 0.81 CHRNB2 (0.47) MEN1KMT2A

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 ESR2 1435/4885ESR1 1151/4885LMNA 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.