SCHEMBL5637488

SCHEMBL5637488

Cc1ncnc2c1CCC(=O)N2

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
CRBN Q96SW2 3/20 0.36
AKT1 P31749 1/20 0.35
AKT2 P31751 1/20 0.35
AKT3 Q9Y243 1/20 0.35
SRC P12931 1/20 0.34
TNNI3K Q59H18 1/20 0.33
SRD5A1 P18405 1/20 0.31
DDB1 Q16531 1/20 0.30

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
SCHEMBL12382071 0.83 SRC (0.46) PDE3BPDE3ASRCTNNI3K
SCHEMBL1531608 0.78 AKT1 (0.37) CRBNAKT1AKT2AKT3TNNI3K
SCHEMBL18297361 0.78 KDR (0.42) CRBNAKT1AKT2AKT3TNNI3K
SCHEMBL12775785 0.77 AKT1 (0.35) PDE3BPDE3ACRBNAKT1AKT2
SCHEMBL12775969 0.75 AKT1 (0.36) CRBNAKT1AKT2AKT3DDB1
SCHEMBL21823060 0.75 AKT1 (0.32) CRBNAKT1AKT2AKT3TNNI3K
SCHEMBL12775796 0.75 AKT1 (0.34) PDE3BPDE3ACRBNAKT1AKT2
SCHEMBL10267990 0.74 PDE3B (0.40) PDE3BPDE3ACRBNDDB1
SCHEMBL14494423 0.73 PDE3B (0.39) PDE3BPDE3ACRBN
SCHEMBL24035072 0.73 AKT1 (0.51) AKT1AKT2AKT3

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
EP-2044077-B1 DERIVATIVES AND ANALOGS OF N-ETHYLQUINOLONES AND N-ETHYLAZAQUINOLONES GLAXO GROUP LTD (GB) 2016-10-05 EP disclosed
WO-2008128942-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS AS ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2008-10-30 WO disclosed
US-7307082-B2 Heterocyclic derivatives as CRF antagonists ROCHE PALO ALTO LLC (US) 2007-12-11 US disclosed
US-20040224964-A1 Heterocyclic derivatives as CRF antagonists ROCHE PALO ALTO LLC 2004-11-11 US 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-20040224964-A1 Heterocyclic derivatives as CRF antagonists CRHR1, CRHR2, CNR1 PDE3B 872/4885PDE3A 730/4885CRBN 909/4885

“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.