SCHEMBL5929230

SCHEMBL5929230

CCc1ccccc1-c1nc(Cl)c(CN2CCCCC2c2ccc3c(c2)OCCO3)n1CC1OCCO1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.39
▸ BCHE P06276 1/20 0.38
▸ CD274 Q9NZQ7 7/20 0.37
▸ PDCD1 Q15116 6/20 0.37
▸ KDM4E B2RXH2 4/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ TERT O14746 1/20 0.35

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
SCHEMBL5929107 0.97 KDM4E (0.39) POLBBCHECD274PDCD1KDM4E
SCHEMBL5929168 0.87 KMT2A (0.39) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL5929006 0.86 IL33 (0.41) POLBKDM4EMEN1ALDH1A1LMNA
SCHEMBL5928936 0.85 KDM4E (0.46) POLBKDM4EMEN1ALDH1A1LMNA
SCHEMBL5929124 0.82 BCHE (0.37) POLBBCHECD274PDCD1KDM4E
SCHEMBL5929326 0.82 KDM4E (0.44) CD274PDCD1KDM4EMEN1ALDH1A1
SCHEMBL5929147 0.81 POLB (0.40) POLBBCHECD274PDCD1KDM4E
SCHEMBL5928975 0.81 CNR1 (0.37) POLBCD274PDCD1KDM4EMEN1
SCHEMBL5929097 0.81 POLB (0.39) POLBBCHECD274PDCD1KDM4E
SCHEMBL5928930 0.80 KDM4E (0.39) POLBCD274PDCD1KDM4EMEN1

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 POLB 4751/4885BCHE 3023/4885CD274 2140/4885

“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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