SCHEMBL5929034

SCHEMBL5929034

CCc1cccc(-c2nc(-c3c(CC)cccc3CC)n(CC)c2CN2CCCCC2c2ccccc2)c1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CFB P00751 3/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ KDM4E B2RXH2 3/20 0.37
▸ GAA P10253 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ CD274 Q9NZQ7 1/20 0.34
▸ DRD2 P14416 3/20 0.34
▸ DRD3 P35462 3/20 0.34
▸ DRD4 P21917 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
SCHEMBL5929363 0.93 KMT2A (0.39) CFBALDH1A1KDM4EGAAKMT2A
SCHEMBL5929042 0.92 CFB (0.38) CFBALDH1A1KDM4EGAAKMT2A
SCHEMBL5928958 0.91 LMNA (0.43) CFBALDH1A1KDM4EGAANPSR1
SCHEMBL5928966 0.91 ALDH1A1 (0.42) CFBALDH1A1KDM4EGAASMN1; SMN2
SCHEMBL5929174 0.90 CFB (0.37) CFBALDH1A1KDM4EGAAHTT
SCHEMBL5929035 0.90 CFB (0.39) CFBALDH1A1KDM4EGAAKMT2A
SCHEMBL5929198 0.89 KDM4E (0.45) ALDH1A1KDM4EGAAKMT2AL3MBTL1
SCHEMBL5929141 0.89 KMT2A (0.38) CFBALDH1A1KDM4EGAAHTT
SCHEMBL5929188 0.88 NPSR1 (0.40) CFBALDH1A1KDM4EGAANPSR1
SCHEMBL5928934 0.88 LMNA (0.37) CFBALDH1A1KDM4EGAASMN1; SMN2

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 26/4885ALDH1A1 3884/4885KDM4E 1762/4885

“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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