SCHEMBL5929105

SCHEMBL5929105

CCc1cccc(CC)c1-c1nc(-c2ccc(F)cc2F)c(CN2CCCCC2c2ccccc2)n1CC

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ ALDH1A1 P00352 4/20 0.39
▸ KMT2A Q03164 4/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ POLB P06746 1/20 0.38
▸ SCN9A Q15858 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ GAA P10253 1/20 0.36
▸ P2RX7 Q99572 1/20 0.36
▸ CFB P00751 2/20 0.36
▸ BRD4 O60885 1/20 0.35
▸ DRD2 P14416 3/20 0.34
▸ DRD3 P35462 3/20 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
SCHEMBL5929204 0.93 LMNA (0.39) LMNAMAPK1ALDH1A1KMT2AMEN1
SCHEMBL5929208 0.93 LMNA (0.40) LMNAMAPK1ALDH1A1KMT2AMEN1
SCHEMBL5929008 0.92 LMNA (0.41) LMNAALDH1A1KMT2AMEN1SCN9A
SCHEMBL5929316 0.92 ALDH1A1 (0.40) LMNAALDH1A1KMT2AMEN1POLB
SCHEMBL5928958 0.88 LMNA (0.43) LMNAALDH1A1KMT2AMEN1POLB
SCHEMBL5928984 0.88 ALDH1A1 (0.41) LMNAALDH1A1KMT2AMEN1SCN9A
SCHEMBL5928973 0.88 KMT2A (0.39) LMNAALDH1A1KMT2AMEN1KDM4E
SCHEMBL5929291 0.87 GAA (0.42) ALDH1A1KMT2APOLBKDM4EMAPT
SCHEMBL5929076 0.86 CFB (0.41) LMNAALDH1A1KMT2AMEN1KDM4E
SCHEMBL5928934 0.86 LMNA (0.37) LMNAALDH1A1KMT2AMEN1POLB

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 4776/4885MAPK1 1079/4885ALDH1A1 3884/4885

“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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