SCHEMBL4445007

SCHEMBL4445007

COc1ccc(C(CC(N)=O)N2Cc3ccccc3C2=O)cc1

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.72
KMT2A Q03164 5/20 0.72
TP53 P04637 4/20 0.68
TNF P01375 2/20 0.67
MAPT P10636 6/20 0.66
RAB9A P51151 1/20 0.63
POLB P06746 1/20 0.62
LMNA P02545 1/20 0.53

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
SCHEMBL5515814 0.95 MEN1 (0.66) MEN1KMT2ATP53TNFMAPT
SCHEMBL5512040 0.91 MEN1 (0.61) MEN1KMT2ATP53TNFMAPT
SCHEMBL4441275 0.90 KMT2A (0.73) MEN1KMT2ATP53MAPTRAB9A
SCHEMBL4889555 0.89 MEN1 (0.60) MEN1KMT2ATP53TNFMAPT
SCHEMBL825515 0.87 MEN1 (0.71) MEN1KMT2ATP53MAPTPOLB
SCHEMBL476983 0.87 PDE4A (0.69) MEN1KMT2ATP53TNFMAPT
SCHEMBL717039 0.87 PDE4A (0.69) MEN1KMT2ATP53TNFMAPT
SCHEMBL29840774 0.87 PDE4A (0.69) MEN1KMT2ATP53TNFMAPT
SCHEMBL5941456 0.87 PDE4A (0.69) MEN1KMT2ATP53TNFMAPT
SCHEMBL23706241 0.86 MEN1 (0.82) MEN1KMT2ATP53MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5698579-A INHIBITOR OF TUMOR NECROSIS FACTOR CELGENE CORPORATION (US) 1997-12-16 US claimed
CN-105873611-A Compositions and methods for the treatment of viral diseases with PDE4 modulators 细胞基因公司 2016-08-17 CN disclosed
US-20090010886-A1 Method for the Treatment of Myeloproliferative Diseases Using(+)-2-[1-(3-Ethoxy-4-Methoxyphenyl)-2- Methylsulfonylethyl]-4- Acetylaminoisoindoline-1,3- Dione CELGENE CORPORATION (US) 2009-01-08 US disclosed
US-6200987-B1 ADMINISTERING AS TUMOR NECROSIS FACTOR INHIBITORS; CACHEXIA, ENDOTOXIN SHOCK; RETROVIRUS VIRICIDES CELGENE CORPORATION 2001-03-13 US disclosed
US-6075041-A TUMOR NECROSIS FACTOR CELGENE CORPORATION (US) 2000-06-13 US disclosed
US-5877200-A Cyclic amides CELGENE CORPORATION (US) 1999-03-02 US disclosed
US-5698579-A INHIBITOR OF TUMOR NECROSIS FACTOR CELGENE CORPORATION (US) 1997-12-16 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-20090010886-A1 Method for the Treatment of Myeloproliferative Diseases Using(+)-2-[1-(3-Ethoxy-4-Methoxyphenyl)-2- Methylsulfonylethyl]-4- Acetylaminoisoindoline-1,3- Dione IL2, MCL1, IL1A MEN1 389/4885KMT2A 1703/4885TP53 195/4885

“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.