SCHEMBL6614913

SCHEMBL6614913

CN1CCC(N(C)Cc2ccc(N)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.57
ALDH1A1 P00352 1/20 0.57
LTA4H P09960 1/20 0.53
HRH3 Q9Y5N1 2/20 0.50
HRH4 Q9H3N8 1/20 0.50
NOS2 P35228 6/20 0.49
NOS3 P29474 5/20 0.49
NOS1 P29475 5/20 0.49
LMNA P02545 1/20 0.47
LSS P48449 1/20 0.46
MAP4K4 O95819 2/20 0.45
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
SIGMAR1 Q99720 1/20 0.43

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
SCHEMBL13887902 0.85 KDM4E (0.58) KDM4EALDH1A1LTA4HHRH3HRH4
SCHEMBL8251941 0.85 HTR2A (0.58) KDM4EALDH1A1LTA4HHRH3HRH4
SCHEMBL9451684 0.84 KDM4E (0.49) KDM4EALDH1A1LTA4HHRH3HRH4
SCHEMBL18412166 0.84 KDM4E (0.57) KDM4EALDH1A1LTA4HHRH3HRH4
SCHEMBL17285892 0.84 LSS (0.64) KDM4EALDH1A1LTA4HHRH3HRH4
SCHEMBL17286021 0.84 NOS2 (0.59) KDM4EALDH1A1LTA4HHRH3HRH4
SCHEMBL8442356 0.83 KDM4E (0.68) KDM4EALDH1A1LTA4HHRH3HRH4
SCHEMBL3085764 0.81 HRH3 (0.74) KDM4EALDH1A1LTA4HHRH3HRH4
SCHEMBL17286016 0.81 HTR2A (0.55) KDM4EALDH1A1LTA4HHRH3HRH4
SCHEMBL29956663 0.80 KDM4E (0.53) KDM4EALDH1A1LTA4HHRH3HRH4

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
EP-1313732-B1 OXINDOLE DERIVATIVES GLAXO GROUP LTD (GB) 2004-11-03 EP disclosed
US-6720332-B2 Oxindole derivatives SMITHKLINE BEECHAM CORPORATION 2004-04-13 US disclosed
US-20030195189-A1 Oxindole derivatives SMITHKLINE BEECHAM CORPORATION 2003-10-16 US disclosed
EP-1313732-A1 OXINDOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 2003-05-28 EP disclosed
WO-2002020524-A1 OXINDOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 2002-03-14 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-20030195189-A1 Oxindole derivatives CDK4, CCNI, CCNO KDM4E 1346/4885ALDH1A1 2383/4885LTA4H 3392/4885

“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.