SCHEMBL5126754

SCHEMBL5126754

CCOC(=O)c1c(N2CCNCC2)c2cc(C)ccc2n(-c2ccccc2)c1=O

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.54
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
THRB P10828 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TSHR P16473 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
PNP P00491 2/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL4755207 0.90 RECQL (0.64) RECQLMEN1KMT2AALDH1A1
SCHEMBL4893109 0.89 RECQL (0.55) RECQLMEN1KMT2ATHRBSMN1; SMN2
SCHEMBL4752604 0.88 RECQL (0.53) RECQLMEN1KMT2ATHRBSMN1; SMN2
SCHEMBL14177949 0.85 KDM4E (0.50) ALDH1A1
SCHEMBL5121080 0.82 KDM4E (0.47) MEN1KMT2AALDH1A1
SCHEMBL4788204 0.80 RECQL (0.78) RECQLMEN1KMT2ATHRBSMN1; SMN2
SCHEMBL4699355 0.79 RECQL (0.63) RECQLMEN1KMT2ATHRBSMN1; SMN2
SCHEMBL14177944 0.79 PLA2G2A (0.40) MEN1KMT2AALDH1A1
SCHEMBL4753593 0.79 RECQL (0.65) RECQLMEN1KMT2AALDH1A1
SCHEMBL14177945 0.78 MAPT (0.52) RECQLSMN1; SMN2TSHRALDH1A1

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
CN-101466681-A Tumor necrosis factor alpha inhibitors and their use in the treatment of human diseases AVANIR PHARMACEUTICALS (US) 2009-06-24 CN disclosed
US-20080139551-A1 TUMOR NECROSIS FACTOR ALPHA INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN DISEASES AVANIR PHARMACEUTICALS (US) 2008-06-12 US disclosed
US-20080139551-A1 TUMOR NECROSIS FACTOR ALPHA INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN DISEASES AVANIR PHARMACEUTICALS (US) 2008-06-12 US disclosed
US-20080139551-A1 TUMOR NECROSIS FACTOR ALPHA INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN DISEASES AVANIR PHARMACEUTICALS (US) 2008-06-12 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-20080139551-A1 TUMOR NECROSIS FACTOR ALPHA INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN DISEASES TNF, TNFRSF1A, TNFRSF9 RECQL 3348/4885MEN1 1912/4885KMT2A 4748/4885

“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.