SCHEMBL3656940

SCHEMBL3656940

CN(C)CCOc1cccc(Oc2ccc(Cl)nc2)c1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.54
▸ CHRNB2 P17787 4/20 0.51
▸ CHRNA4 P43681 4/20 0.51
▸ KDM4E B2RXH2 4/20 0.51
▸ ALDH1A1 P00352 2/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ MAPT P10636 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ NOS1 P29475 1/20 0.44
▸ NOS2 P35228 1/20 0.44

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
SCHEMBL2477752 0.84 CHRNB2 (0.56) LTA4HCHRNB2CHRNA4MAPT
SCHEMBL3653085 0.77 APP (0.51) NOS1NOS2
SCHEMBL11713528 0.76 LTA4H (0.58) LTA4HCHRNB2CHRNA4KDM4EALDH1A1
SCHEMBL10261014 0.75 KDM4E (0.82) LTA4HCHRNB2CHRNA4KDM4EALDH1A1
SCHEMBL11543800 0.75 CYP1A2 (0.50) LMNA
SCHEMBL30862627 0.73 CHRNB2 (0.67) LTA4HCHRNB2CHRNA4KDM4EALDH1A1
SCHEMBL16858365 0.73 CHRNB2 (0.67) LTA4HCHRNB2CHRNA4KDM4EALDH1A1
SCHEMBL5025139 0.73 CHRNB2 (0.67) LTA4HCHRNB2CHRNA4KDM4EALDH1A1
SCHEMBL3652838 0.73 ALDH1A1 (0.58) LTA4HKDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL3652757 0.72 MAOB (0.55) LTA4HALDH1A1SMN1; SMN2MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298325-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2010-11-25 — — US disclosed
US-20100298325-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2010-11-25 — — US disclosed
EP-2205317-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES Senexis Limited (GB) 2010-07-14 — — EP disclosed
WO-2009044160-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2009-04-09 — — WO disclosed
WO-2009044160-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2009-04-09 — — WO 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-20100298325-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES HCRTR1, HCRTR2, RTN3 LTA4H 2888/4885CHRNB2 94/4885CHRNA4 108/4885

“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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