SCHEMBL5928934

SCHEMBL5928934

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.37
▸ SCN9A Q15858 1/20 0.37
▸ CFB P00751 2/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ GAA P10253 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ CPT1A P50416 1/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ TSHR P16473 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ PDCD1 Q15116 1/20 0.34
▸ CD274 Q9NZQ7 1/20 0.34
▸ CRHR1 P34998 1/20 0.34
▸ POLB P06746 1/20 0.33
▸ DRD2 P14416 2/20 0.33
▸ DRD3 P35462 2/20 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
SCHEMBL5928931 0.91 GAA (0.42) ALDH1A1GAAKMT2AKDM4EMAPT
SCHEMBL5928958 0.91 LMNA (0.43) LMNASCN9ACFBALDH1A1GAA
SCHEMBL5928984 0.91 ALDH1A1 (0.41) LMNASCN9ACFBALDH1A1GAA
SCHEMBL5929174 0.90 CFB (0.37) LMNASCN9ACFBALDH1A1GAA
SCHEMBL5929035 0.90 CFB (0.39) LMNASCN9ACFBALDH1A1GAA
SCHEMBL5929363 0.90 KMT2A (0.39) LMNASCN9ACFBALDH1A1GAA
SCHEMBL5928966 0.89 ALDH1A1 (0.42) LMNACFBALDH1A1GAAKMT2A
SCHEMBL5929042 0.89 CFB (0.38) LMNACFBALDH1A1GAAKMT2A
SCHEMBL5929038 0.89 DRD2 (0.40) LMNACFBALDH1A1GAAKMT2A
SCHEMBL5929141 0.89 KMT2A (0.38) LMNACFBALDH1A1GAAKMT2A

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 LMNA 4776/4885SCN9A 2252/4885CFB 26/4885

“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.

Send feedback