SCHEMBL3231892

SCHEMBL3231892

CCCCN1C[C@H]2C[C@H](N)C[C@H]2C1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GLB1 P16278 1/20 0.48
GNAI3 P08754 3/20 0.44
GNAO1 P09471 3/20 0.44
GNAI1 P63096 3/20 0.44
GBA1 P04062 3/20 0.43
SIGMAR1 Q99720 8/20 0.41
GUSB P08236 2/20 0.41
EBP Q15125 1/20 0.41
HRH3 Q9Y5N1 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
SCHEMBL6066308 1.00 GLB1 (0.48) GLB1GNAI3GNAO1GNAI1GBA1
SCHEMBL3242510 1.00 GLB1 (0.48) GLB1GNAI3GNAO1GNAI1GBA1
SCHEMBL3231907 1.00 GLB1 (0.48) GLB1GNAI3GNAO1GNAI1GBA1
SCHEMBL13377081 0.87 GLB1 (0.56) GLB1GNAI3GNAO1GNAI1GBA1
SCHEMBL21701406 0.82
SCHEMBL13291907 0.81 GLB1 (0.50) GLB1GNAI3GNAO1GNAI1GBA1
SCHEMBL20858275 0.78 GUSB (0.59) GLB1GNAI3GNAO1GNAI1GBA1
SCHEMBL20858345 0.78 GUSB (0.59) GLB1GNAI3GNAO1GNAI1GBA1
SCHEMBL19275301 0.78 GUSB (0.59) GLB1GNAI3GNAO1GNAI1GBA1
SCHEMBL12524618 0.78 SMN1; SMN2 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7745462-B2 Quinoline-2-one derivatives for the treatment of airways diseases NOVARTIS AG (CH) 2010-06-29 US disclosed
US-20070066607-A1 Quinoline-2-one derivatives for the treatment of airways diseases NOVARTIS AG (CH) 2007-03-22 US disclosed
EP-1613315-A1 QUINOLINE-2-ONE-DERIVATIVES FOR THE TREATMENT OF AIRWAYS DISEASES Novartis AG (CH) 2006-01-11 EP disclosed
WO-2004087142-A1 QUINOLINE-2-ONE-DERIVATIVES FOR THE TREATMENT OF AIRWAYS DISEASES NOVARTIS AG (CH) 2004-10-14 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-20070066607-A1 Quinoline-2-one derivatives for the treatment of airways diseases ADRB2, ADRA2C, ADRB1 GLB1 2086/4885GNAI3 182/4885GNAO1 129/4885

“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.