SCHEMBL5928930

SCHEMBL5928930

CCc1ccccc1-c1nc(Cl)c(CN2CCCCC2c2ccc(OC)c(C)c2C)n1CC1OCCO1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CD274 Q9NZQ7 10/20 0.37
▸ PDCD1 Q15116 5/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ HCRTR1 O43613 2/20 0.36
▸ HCRTR2 O43614 2/20 0.36
▸ SMN1; SMN2 Q16637 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
SCHEMBL5929254 0.92 KDM4E (0.42) KDM4EALDH1A1CD274PDCD1KMT2A
SCHEMBL5929326 0.91 KDM4E (0.44) KDM4EALDH1A1CD274PDCD1KMT2A
SCHEMBL5929168 0.89 KMT2A (0.39) KDM4EALDH1A1KMT2AMEN1LMNA
SCHEMBL5929006 0.86 IL33 (0.41) KDM4EALDH1A1KMT2AMEN1LMNA
SCHEMBL5928936 0.85 KDM4E (0.46) KDM4EALDH1A1KMT2AMEN1LMNA
SCHEMBL5929150 0.82 KDM4E (0.50) KDM4EALDH1A1CD274PDCD1KMT2A
SCHEMBL5928975 0.81 CNR1 (0.37) KDM4ECD274PDCD1KMT2AMEN1
SCHEMBL5929107 0.80 KDM4E (0.39) KDM4EALDH1A1CD274PDCD1KMT2A
SCHEMBL5929230 0.80 POLB (0.39) KDM4EALDH1A1CD274PDCD1KMT2A
SCHEMBL5929011 0.79 KMT2A (0.38) KDM4EALDH1A1CD274PDCD1KMT2A

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 KDM4E 1762/4885ALDH1A1 3884/4885CD274 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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