SCHEMBL5929009

SCHEMBL5929009

CCOCCn1c(-c2c(CC)cccc2CC)nc(Cl)c1CN1CCOC[C@H]1c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ KCNH2 Q12809 2/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ CD274 Q9NZQ7 1/20 0.32
▸ CFB P00751 1/20 0.32
▸ HRH1 P35367 3/20 0.30
▸ CHRM1 P11229 1/20 0.30
▸ SMN1; SMN2 Q16637 2/20 0.30
▸ LMNA P02545 1/20 0.30
▸ GSK3B P49841 1/20 0.30
▸ HSD17B10 Q99714 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
SCHEMBL5929125 0.80 GAA (0.40) ALDH1A1KDM4ECFBSMN1; SMN2
SCHEMBL5929054 0.77 ALDH1A1 (0.38) ALDH1A1KDM4ESMN1; SMN2LMNAHSD17B10
SCHEMBL5929304 0.75 MEN1 (0.34) ALDH1A1KDM4ECFBSMN1; SMN2LMNA
SCHEMBL5928948 0.73 OPRK1 (0.40) ALDH1A1KDM4ELMNA
SCHEMBL5928908 0.73 POLB (0.38) ALDH1A1KDM4ECD274LMNA
SCHEMBL5929050 0.73 SLC2A1 (0.40) ALDH1A1KDM4ECFBLMNAHSD17B10
SCHEMBL5928938 0.72 KMT2A (0.39) ALDH1A1KDM4ECFBSMN1; SMN2
SCHEMBL5929075 0.70 PDCD1 (0.31) CD274
SCHEMBL5929248 0.70 KDM4E (0.33) ALDH1A1KDM4ECD274SMN1; SMN2LMNA
SCHEMBL5929216 0.70 OPRK1 (0.39) ALDH1A1KDM4E

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-20060154917-A1 Substituted (heterocycloalkyl)methyl azole derivatives as c5a receptor modulators NEUROGEN CORPORATION (US) 2006-07-13 — — 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-20060154917-A1 Substituted (heterocycloalkyl)methyl azole derivatives as c5a receptor modulators C5AR1, C5AR2, C3AR1 MDM2 2497/4885ALDH1A1 3884/4885KCNH2 2944/4885

“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.

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