SCHEMBL4856808

SCHEMBL4856808

CC(Oc1cc(-c2ccccc2)nc2ccccc12)c1c[nH]nn1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.53
LMNA P02545 3/20 0.53
HPGD P15428 2/20 0.53
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
ACHE P22303 1/20 0.43
ACACA Q13085 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 1/20 0.40
ACP1 P24666 1/20 0.39
PDE10A Q9Y233 1/20 0.38

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
SCHEMBL4847213 0.83 SMN1; SMN2 (0.37) SMN1; SMN2LMNAHPGDKDM4EALDH1A1
SCHEMBL4853815 0.82 LMNA (0.35) SMN1; SMN2LMNAHPGDKDM4EALDH1A1
SCHEMBL10675207 0.73 LMNA (0.60) SMN1; SMN2LMNAHPGDKDM4EALDH1A1
SCHEMBL955714 0.71 SMN1; SMN2 (1.00) SMN1; SMN2LMNAHPGDKDM4EALDH1A1
SCHEMBL10673201 0.70 SMN1; SMN2 (0.60) SMN1; SMN2LMNAHPGDKDM4EALDH1A1
SCHEMBL10680469 0.69 HPGD (0.51) SMN1; SMN2LMNAHPGDKDM4EALDH1A1
SCHEMBL14696931 0.68 LMNA (0.54) SMN1; SMN2LMNAHPGDKDM4EALDH1A1
SCHEMBL10677829 0.68 HPGD (0.53) SMN1; SMN2LMNAHPGDKDM4EALDH1A1
SCHEMBL10199984 0.68 SMN1; SMN2 (0.70) SMN1; SMN2LMNAHPGDKDM4EALDH1A1
SCHEMBL3969705 0.68 SMN1; SMN2 (0.70) SMN1; SMN2LMNAHPGDKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050154008-A1 Aryl fused substituted 4-oxy-pyridines NEUROGEN CORPORATION, A CORPORATION OF THE STATE OF DELAWARE (US) 2005-07-14 US claimed
US-20020035121-A1 Aryl fused substituted 4-oxy-pyridines CAI GUOLIN (US) 2002-03-21 US claimed
WO-2002000623-A2 ARYL FUSED SUBSTITUTED 4-OXY-PYRIDINES NEUROGEN CORPORATION (US) 2002-01-03 WO claimed
US-7371752-B2 Aryl fused substituted 4-oxy-pyridines NEUROGEN CORPORATION (US) 2008-05-13 US disclosed
US-20050154008-A1 Aryl fused substituted 4-oxy-pyridines NEUROGEN CORPORATION, A CORPORATION OF THE STATE OF DELAWARE (US) 2005-07-14 US disclosed
US-6828329-B2 Agonists, antagonists for gamma-aminobutyric acid brain receptors useful in diagnosis and treatment of anxiety depressionm, down syndrome, sleep and seizure disorders NEUROGEN CORPORATION 2004-12-07 US disclosed
US-20020035121-A1 Aryl fused substituted 4-oxy-pyridines CAI GUOLIN (US) 2002-03-21 US disclosed
WO-2002000623-A2 ARYL FUSED SUBSTITUTED 4-OXY-PYRIDINES NEUROGEN CORPORATION (US) 2002-01-03 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 (2 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-20050154008-A1 Aryl fused substituted 4-oxy-pyridines CHRNA7, CHRNA4, GABRA6 SMN1; SMN2 1244/4885LMNA 577/4885HPGD 1375/4885
US-20020035121-A1 Aryl fused substituted 4-oxy-pyridines GABRA4, GABRA6, GABRG2 SMN1; SMN2 984/4885LMNA 579/4885HPGD 1608/4885

“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.