SCHEMBL4979209

SCHEMBL4979209

O=C(O)N1CCC(COc2ccc(Cl)nn2)CC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.42
CHRNA4 P43681 1/20 0.42
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
ACHE P22303 2/20 0.40
LIPE Q05469 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GRIN2B Q13224 1/20 0.37
FFAR4 Q5NUL3 1/20 0.36
CNR2 P34972 1/20 0.36

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
SCHEMBL20919479 0.84 CHRNB2 (0.39) CHRNB2CHRNA4LMNAHTTMEN1
SCHEMBL388491 0.83 KDM4E (0.47)
SCHEMBL23523234 0.82 CHRNB2 (0.46) CHRNB2CHRNA4LMNAHTTMEN1
SCHEMBL23933677 0.82 CHRNB2 (0.46) CHRNB2CHRNA4LMNAHTTMEN1
SCHEMBL3842144 0.81 GRIN2B (0.43) GRIN2B
SCHEMBL410479 0.81 CHRNB2 (0.54) CHRNB2CHRNA4
SCHEMBL22609209 0.81 CHRNB2 (0.40) CHRNB2CHRNA4LMNAHTTACHE
SCHEMBL2705546 0.80 FFAR4 (0.39) ACHEMEN1KMT2AGRIN2BFFAR4
SCHEMBL5272344 0.80 GPR119 (0.43) LMNAHTTLIPEMEN1KMT2A
SCHEMBL4259566 0.79 CHRNA3 (0.53) CHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008025799-A1 PYRIDAZINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 WO disclosed
US-20080058339-A1 New compounds BIOVITRUM (SE) 2008-03-06 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-20080058339-A1 New compounds GPR119, GPR180, GPR139 CHRNB2 384/4885CHRNA4 423/4885LMNA 3656/4885

“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.