SCHEMBL5928984

SCHEMBL5928984

CCc1cccc(CC)c1-c1nc(-c2ccc(F)cc2)c(CN2CCCCC2c2ccccc2)n1CC

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ KMT2A Q03164 4/20 0.40
▸ LMNA P02545 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KDM4E B2RXH2 4/20 0.39
▸ MAPT P10636 2/20 0.39
▸ GAA P10253 1/20 0.38
▸ CFB P00751 2/20 0.36
▸ ADORA2A P29274 1/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ SCN9A Q15858 1/20 0.35
▸ KCNK3 O14649 2/20 0.35
▸ KCNK9 Q9NPC2 2/20 0.35
▸ NT5E P21589 1/20 0.34
▸ CPT1A P50416 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 0.94 KMT2A (0.39) ALDH1A1L3MBTL1KMT2ALMNAMEN1
SCHEMBL5929141 0.93 KMT2A (0.38) ALDH1A1KMT2ALMNAKDM4EMAPT
SCHEMBL5929090 0.91 KDM4E (0.38) ALDH1A1KMT2ALMNAKDM4EGAA
SCHEMBL5928958 0.91 LMNA (0.43) ALDH1A1L3MBTL1KMT2ALMNAMEN1
SCHEMBL5929038 0.91 DRD2 (0.40) ALDH1A1KMT2ALMNAMEN1KDM4E
SCHEMBL5928934 0.91 LMNA (0.37) ALDH1A1L3MBTL1KMT2ALMNAMEN1
SCHEMBL5929296 0.90 GAA (0.35) ALDH1A1L3MBTL1KMT2ALMNAKDM4E
SCHEMBL5929122 0.90 KMT2A (0.41) ALDH1A1L3MBTL1KMT2ALMNAMEN1
SCHEMBL5929078 0.90 KCNK3 (0.37) ALDH1A1KMT2ALMNAMEN1KDM4E
SCHEMBL5928924 0.89 KMT2A (0.37) ALDH1A1KMT2AMEN1KDM4EMAPT

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 ALDH1A1 3884/4885L3MBTL1 4342/4885KMT2A 2955/4885

“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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