SCHEMBL6502285

SCHEMBL6502285

CCC(NC(=O)C1CCCCCC1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PADI1 Q9ULC6 1/20 0.45
PADI4 Q9UM07 1/20 0.45
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
LMNA P02545 3/20 0.44
NAAA Q02083 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
GAA P10253 2/20 0.42
ALOX15 P16050 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
EPHX1 P07099 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
PSMB5 P28074 1/20 0.41
RECQL P46063 1/20 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
SCHEMBL5730708 0.98 LMNA (0.45) PADI1PADI4HDAC8HDAC6LMNA
SCHEMBL1953634 0.91 LMNA (0.50) LMNATDP1GAAPSMB5RECQL
SCHEMBL1953631 0.91 LMNA (0.50) LMNATDP1GAAPSMB5RECQL
SCHEMBL9829322 0.86 NAAA (0.45) PADI1PADI4HDAC8HDAC6LMNA
SCHEMBL9829324 0.86 NAAA (0.45) PADI1PADI4HDAC8HDAC6LMNA
SCHEMBL10669991 0.84 LMNA (0.43) PADI1PADI4LMNANAAATDP1
SCHEMBL10669986 0.84 LMNA (0.43) PADI1PADI4LMNANAAATDP1
SCHEMBL2795524 0.84 HDAC8 (0.45) PADI1PADI4HDAC8HDAC6LMNA
SCHEMBL2794690 0.84 HDAC8 (0.45) PADI1PADI4HDAC8HDAC6LMNA
SCHEMBL2797000 0.84 HDAC8 (0.45) PADI1PADI4HDAC8HDAC6LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6878708-B2 Imidazotriazinones and the use thereof BAYER AKTIENGESELLSCHAFT (DE) 2005-04-12 US disclosed
US-20040097498-A1 Novel imidazotriazinones and the use thereof BAYER AKTIENGESELLSCHAFT (DE) 2004-05-20 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-20040097498-A1 Novel imidazotriazinones and the use thereof CYP4F3, CYP4F2, CYP3A7 PADI1 2595/4885PADI4 2971/4885HDAC8 2991/4885

“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.