SCHEMBL3290755

SCHEMBL3290755

CCOC(=O)N1CCC(Nc2ccc3c(c2)CC(=O)N3)CC1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.55
LMNA P02545 2/20 0.55
TSHR P16473 1/20 0.53
MAPT P10636 4/20 0.53
ALDH1A1 P00352 3/20 0.53
USP2 O75604 2/20 0.53
GRIN1 Q05586 2/20 0.52
GRIN2B Q13224 2/20 0.52
GRIN2D O15399 1/20 0.52
GRIN3B O60391 1/20 0.52
GRIN2A Q12879 1/20 0.52
GRIN2C Q14957 1/20 0.52
GRIN3A Q8TCU5 1/20 0.52
GAA P10253 2/20 0.51
SMYD3 Q9H7B4 2/20 0.50
NOS2 P35228 5/20 0.49
NOS1 P29475 4/20 0.49
NOS3 P29474 2/20 0.49
NPSR1 Q6W5P4 2/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL28811700 0.86 ALDH1A1 (0.61) KDM4EMAPTALDH1A1GRIN1GRIN2B
SCHEMBL3283892 0.82 KDM4E (0.50) KDM4EGRIN1GRIN2BGRIN2DGRIN3B
SCHEMBL13586867 0.81 POLB (0.52) MAPTGRIN1GRIN2BGRIN2DGRIN3B
SCHEMBL764570 0.79 ALDH1A1 (0.65) KDM4ELMNAMAPTALDH1A1USP2
SCHEMBL9824736 0.79 MAPT (0.57) KDM4ELMNAMAPTALDH1A1GAA
SCHEMBL16359223 0.78 KDM4E (0.61) KDM4ELMNAMAPTALDH1A1USP2
SCHEMBL11457429 0.77 KDM4E (0.63) KDM4ELMNAMAPTALDH1A1USP2
SCHEMBL5843584 0.75 GAA (0.74) LMNAMAPTALDH1A1GAAHTT
SCHEMBL1196914 0.74 NOS2 (0.65) KDM4ELMNAMAPTALDH1A1USP2
SCHEMBL312970 0.74 KDM4E (0.60) KDM4ELMNATSHRMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7714146-B2 Azulene-oxindole compounds as multiple-kinase inhibitors and useful as anticancer agents INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2010-05-11 US disclosed
US-20080125590-A1 Azulene compounds INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2008-05-29 US disclosed
EP-1918277-A2 Azulene compounds Industrial Technology Research Institute (TW) 2008-05-07 EP 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-20080125590-A1 Azulene compounds AZI2, PRMT5, BRCA1 KDM4E 592/4885LMNA 4141/4885TSHR 313/4885

“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.