SCHEMBL3598794

SCHEMBL3598794

Cn1cc(C(=O)O)c2ccc3[nH]ncc3c21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 2/20 0.40
CCNA2 P20248 1/20 0.40
CCNA1 P78396 1/20 0.40
HCAR2 Q8TDS4 1/20 0.37
GRK2 P25098 1/20 0.36
METTL3 Q86U44 8/20 0.36
ACACB O00763 1/20 0.35
ACACA Q13085 1/20 0.35
POLB P06746 1/20 0.33
IDO1 P14902 1/20 0.33
CCNE1 P24864 1/20 0.33
CDK3 Q00526 1/20 0.33
METAP2 P50579 2/20 0.33
MAPK1 P28482 1/20 0.33
MAP2K4 P45985 1/20 0.33
MAPKAPK3 Q16644 1/20 0.33
MAPK6 Q16659 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
SCHEMBL3597421 0.82 ALDH1A1 (0.46) CDK2GRK2METTL3CCNE1CDK3
SCHEMBL15005568 0.80 CCNA2 (0.37) CDK2CCNA2CCNA1GRK2METTL3
SCHEMBL11459592 0.77 LMNA (0.51) ACACBACACAPOLBMETAP2
SCHEMBL1600742 0.72 CCNA2 (0.42) CDK2CCNA2CCNA1HCAR2IDO1
SCHEMBL3594601 0.70 MCL1 (0.41) CDK2CCNA2CCNA1HCAR2POLB
SCHEMBL8062076 0.70 CCNA2 (0.43) CDK2CCNA2CCNA1HCAR2IDO1
SCHEMBL10593960 0.70 HCAR2 (0.47) CDK2CCNA2CCNA1HCAR2IDO1
SCHEMBL25286660 0.69 NOS1 (0.44) CDK2CCNA2CCNA1HCAR2IDO1
SCHEMBL2192636 0.69 TRPA1 (0.43) CDK2CCNA2CCNA1HCAR2METAP2
SCHEMBL13999326 0.69 CCNA2 (0.45) CDK2CCNA2CCNA1HCAR2IDO1

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