SCHEMBL20152894

SCHEMBL20152894

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.50
CYP2C19 P33261 2/20 0.50
GPR119 Q8TDV5 2/20 0.48
NPSR1 Q6W5P4 2/20 0.46
USP2 O75604 2/20 0.46
HSD17B10 Q99714 2/20 0.46
HPGD P15428 2/20 0.46
KCNH2 Q12809 1/20 0.42
ALDH1A1 P00352 5/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPT P10636 2/20 0.40
GAA P10253 1/20 0.40
SLC6A9 P48067 1/20 0.40
RIPK1 Q13546 1/20 0.40
HDAC6 Q9UBN7 1/20 0.39

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
SCHEMBL18248384 0.87 KDM4E (0.68) KDM4ECYP2C19GPR119NPSR1USP2
SCHEMBL20425004 0.85 KDM4E (0.49) KDM4ECYP2C19NPSR1USP2HSD17B10
SCHEMBL20152891 0.85 RIPK1 (0.53) KDM4ECYP2C19NPSR1USP2HSD17B10
SCHEMBL12639917 0.83 KDM4E (0.72) KDM4ECYP2C19GPR119HPGDALDH1A1
SCHEMBL12036196 0.83 KDM4E (0.46) KDM4ECYP2C19GPR119NPSR1USP2
SCHEMBL18255043 0.83 KDM4E (0.58) KDM4ECYP2C19GPR119NPSR1USP2
SCHEMBL20425044 0.80 KDM4E (0.48) KDM4ECYP2C19NPSR1USP2HSD17B10
SCHEMBL19658643 0.80 CKS1B (0.50) KDM4EGPR119USP2HSD17B10HPGD
SCHEMBL20152892 0.80 HRH3 (0.53) KDM4EGPR119ALDH1A1MEN1KMT2A
SCHEMBL356595 0.79 GPR119 (0.49) KDM4ECYP2C19GPR119NPSR1USP2

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 KDM4E 649/4885CYP2C19 1513/4885GPR119 786/4885

“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.