SCHEMBL5929035

SCHEMBL5929035

CCc1cccc(CC)c1-c1nc(-c2ccc(C)c(C)c2)c(CN2CCCCC2c2ccccc2)n1CC

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CFB P00751 5/20 0.39
▸ EGFR P00533 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ MAPT P10636 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ CRHR1 P34998 1/20 0.34
▸ DRD2 P14416 5/20 0.34
▸ DRD3 P35462 5/20 0.34
▸ SCN9A Q15858 1/20 0.33

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
SCHEMBL5929174 0.91 CFB (0.37) CFBGAAKMT2ALMNAKDM4E
SCHEMBL5929363 0.91 KMT2A (0.39) CFBGAAKMT2ALMNAKDM4E
SCHEMBL5929042 0.90 CFB (0.38) CFBGAAKMT2ALMNAKDM4E
SCHEMBL5929141 0.90 KMT2A (0.38) CFBGAAKMT2ALMNAKDM4E
SCHEMBL5928934 0.90 LMNA (0.37) CFBGAAKMT2ALMNAKDM4E
SCHEMBL5929034 0.90 CFB (0.37) CFBGAAKMT2ALMNAKDM4E
SCHEMBL5928958 0.89 LMNA (0.43) CFBGAAKMT2ALMNAKDM4E
SCHEMBL5928966 0.89 ALDH1A1 (0.42) CFBGAAKMT2ALMNAKDM4E
SCHEMBL5929038 0.89 DRD2 (0.40) CFBGAAKMT2ALMNAKDM4E
SCHEMBL5928984 0.89 ALDH1A1 (0.41) CFBGAAKMT2ALMNAKDM4E

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 26/4885EGFR 663/4885GAA 4885/4885

“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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