SCHEMBL20152891

SCHEMBL20152891

CC(=O)C1CCN(c2ncc(F)cn2)CC1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 4/20 0.53
KDM4E B2RXH2 2/20 0.49
CYP2C19 P33261 1/20 0.49
HCRTR2 O43614 1/20 0.43
USP2 O75604 1/20 0.42
HPGD P15428 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HSD17B10 Q99714 1/20 0.42
SLC6A9 P48067 1/20 0.42
TP53 P04637 1/20 0.41
SIGMAR1 Q99720 2/20 0.41

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
SCHEMBL20152894 0.85 KDM4E (0.50) RIPK1KDM4ECYP2C19USP2HPGD
SCHEMBL15751660 0.85 KDM4E (0.68) RIPK1KDM4ECYP2C19USP2HPGD
SCHEMBL20425004 0.84 KDM4E (0.49) RIPK1KDM4ECYP2C19USP2HPGD
SCHEMBL18255044 0.83 KDM4E (0.57) RIPK1KDM4ECYP2C19HCRTR2HPGD
SCHEMBL12639917 0.81 KDM4E (0.72) KDM4ECYP2C19HPGDTP53
SCHEMBL23851037 0.81 RIPK1 (0.51) RIPK1KDM4ECYP2C19TP53
SCHEMBL28410232 0.81 RIPK1 (0.51) RIPK1KDM4ECYP2C19HCRTR2SLC6A9
SCHEMBL12036196 0.81 KDM4E (0.46) KDM4ECYP2C19USP2HPGDNPSR1
SCHEMBL16769733 0.80 HRH3 (0.55) KDM4EHPGDHSD17B10SLC6A9
SCHEMBL21868474 0.80 KDM4E (0.60) RIPK1KDM4ECYP2C19HCRTR2USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180134665-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-05-17 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-20180134665-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS MAP3K19, MAP3K20, MAP3K1 RIPK1 414/4885KDM4E 649/4885CYP2C19 1513/4885

“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.