SCHEMBL5929076

SCHEMBL5929076

CCc1cccc(CC)c1-c1nc(-c2ccccc2C)c(CN2CCCCC2c2ccccc2)n1CC

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CFB P00751 5/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ LMNA P02545 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ GAA P10253 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.36
▸ CRHBP P24387 1/20 0.35
▸ CRHR2 Q13324 1/20 0.35
▸ DRD2 P14416 5/20 0.35
▸ DRD3 P35462 5/20 0.35
▸ OPRM1 P35372 2/20 0.35
▸ OPRD1 P41143 2/20 0.35
▸ OPRK1 P41145 2/20 0.35
▸ OPRL1 P41146 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ RAB9A P51151 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
SCHEMBL5928973 0.94 KMT2A (0.39) CFBKMT2ALMNAMEN1GAA
SCHEMBL5929207 0.91 CFB (0.41) CFBKMT2ALMNAMEN1GAA
SCHEMBL5929316 0.91 ALDH1A1 (0.40) CFBKMT2ALMNAMEN1GAA
SCHEMBL5929212 0.91 KDM4E (0.44) CFBKMT2ALMNAMEN1GAA
SCHEMBL5929008 0.90 LMNA (0.41) CFBKMT2ALMNAMEN1GAA
SCHEMBL5929241 0.90 KDM4E (0.39) CFBKMT2ALMNAMEN1GAA
SCHEMBL5929208 0.90 LMNA (0.40) CFBKMT2ALMNAMEN1GAA
SCHEMBL5929363 0.90 KMT2A (0.39) CFBKMT2ALMNAMEN1GAA
SCHEMBL5929292 0.90 GAA (0.47) KMT2AGAAKDM4EDRD2DRD3
SCHEMBL5929129 0.90 KDM4E (0.42) CFBKMT2ALMNAMEN1GAA

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 CFB 26/4885KMT2A 2955/4885LMNA 4776/4885

“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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