SCHEMBL5650166

SCHEMBL5650166

CNS(=O)(=O)c1ccc(CCBr)cc1F

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
LMNA P02545 2/20 0.36
CCR2 P41597 4/20 0.35
NMT1 P30419 1/20 0.35
KAT6A Q92794 1/20 0.34
KIF11 P52732 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CXCR4 P61073 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
SCHEMBL5650519 0.83 LMNA (0.44) ALDH1A1LMNAL3MBTL1
SCHEMBL27690017 0.82 CCR2 (0.38) CCR2L3MBTL1
SCHEMBL5652344 0.81 NMT1 (0.41) ALDH1A1LMNANMT1
SCHEMBL19859300 0.81 ALDH1A1 (0.38) ALDH1A1LMNACCR2KIF11L3MBTL1
SCHEMBL5647150 0.79 L3MBTL1 (0.48) ALDH1A1L3MBTL1
SCHEMBL568535 0.76 ADH1B (0.39) ALDH1A1LMNACCR2CXCR4
SCHEMBL2371748 0.75 NMT1 (0.56) ALDH1A1LMNACCR2NMT1KAT6A
SCHEMBL2371266 0.74 CCR2 (0.53) ALDH1A1LMNACCR2KAT6A
SCHEMBL17342883 0.73 GAA (0.48) ALDH1A1LMNACCR2NMT1KAT6A
SCHEMBL5648958 0.73 SMN1; SMN2 (0.53) ALDH1A1LMNAL3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070049620-A1 Cyclic tertiary amine compound SANKYO COMPANY, LIMITED (JP) 2007-03-01 US disclosed
CN-1863793-A Cyclic tertiary amine compound SANKYO CO (JP) 2006-11-15 CN disclosed
EP-1632488-A1 CYCLIC TERTIARY AMINE COMPOUND Sankyo Company, Limited (JP) 2006-03-08 EP 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-20070049620-A1 Cyclic tertiary amine compound MYD88, IL5, BRD4 ALDH1A1 1438/4885LMNA 4146/4885CCR2 235/4885

“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.