SCHEMBL3595135

SCHEMBL3595135

CCOC(=O)c1c2c(n(C)c1C(=O)O)-c1nc(N)ncc1CC2

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 9/20 0.46
CDK2 P24941 9/20 0.46
CCNA1 P78396 9/20 0.46
CDK4 P11802 1/20 0.46
CCND3 P30281 1/20 0.46
CDK6 Q00534 1/20 0.46
USP2 O75604 1/20 0.39
HSP90AA1 P07900 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CFTR P13569 2/20 0.37
AURKA O14965 4/20 0.37
PIM1 P11309 2/20 0.36
TTK P33981 2/20 0.36
PLK1 P53350 1/20 0.36
TSHR P16473 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
PIK3CD O00329 1/20 0.35
PIK3R1 P27986 1/20 0.35

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
SCHEMBL3602606 0.94 CCNA2 (0.45) CCNA2CDK2CCNA1CDK4CCND3
SCHEMBL12466225 0.89 CCNA2 (0.46) CCNA2CDK2CCNA1CDK4CCND3
SCHEMBL3601706 0.88 CCNA2 (0.41) CCNA2CDK2CCNA1CDK4CCND3
SCHEMBL3593089 0.87 CCNA2 (0.44) CCNA2CDK2CCNA1CDK4CCND3
SCHEMBL1559207 0.79 CCNA2 (0.66) CCNA2CDK2CCNA1CDK4CCND3
SCHEMBL3596088 0.78 CCNA2 (0.55) CCNA2CDK2CCNA1CDK4CCND3
SCHEMBL15005623 0.78 CCNA2 (0.43) CCNA2CDK2CCNA1CDK4CCND3
SCHEMBL3596664 0.77 CCNA2 (0.40) CCNA2CDK2CCNA1CDK4CCND3
SCHEMBL3503801 0.76 CCNA2 (0.55) CCNA2CDK2CCNA1CDK4CCND3
SCHEMBL3504023 0.75 CDK2 (0.54) CCNA2CDK2CCNA1CDK4CCND3

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-2118102-B1 TRICYCLIC INDOLES AND (4,5-DIHYDRO) INDOLES NERVIANO MEDICAL SCIENCES SRL (IT) 2013-06-12 EP disclosed
US-8207180-B2 Tricyclic indoles and (4,5-dihydro) indoles NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-06-26 US disclosed
US-20100075998-A1 TRICYCLIC INDOLES AND (4,5-DIHYDRO) INDOLES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-03-25 US disclosed
EP-2118102-A1 TRICYCLIC INDOLES AND (4,5-DIHYDRO) INDOLES Nerviano Medical Sciences S.r.l. (IT) 2009-11-18 EP disclosed
WO-2008065054-A1 TRICYCLIC INDOLES AND (4,5-DIHYDRO) INDOLES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2008-06-05 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-20100075998-A1 TRICYCLIC INDOLES AND (4,5-DIHYDRO) INDOLES CDC7, CDK7, CDK17 CCNA2 75/4885CDK2 9/4885CCNA1 30/4885

“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.