SCHEMBL6699863

SCHEMBL6699863

CN(C)CCOCn1cc(C(=O)NCc2ccc(Cl)cc2)c(=O)c2cc(CN3CCOCC3)ccc21

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.56
KCNH2 Q12809 7/20 0.54
POLA1 P09884 2/20 0.54
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
MAPT P10636 2/20 0.48
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
RECQL P46063 1/20 0.47
ENPP2 Q13822 1/20 0.47
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
SCHEMBL6699126 0.92 F2 (0.58) F2KCNH2POLA1MEN1KMT2A
SCHEMBL6701435 0.91 POLA1 (0.59) F2KCNH2POLA1MEN1KMT2A
SCHEMBL6698934 0.91 KCNH2 (0.59) F2KCNH2POLA1MEN1KMT2A
SCHEMBL6698210 0.89 KCNH2 (0.56) F2KCNH2POLA1MEN1KMT2A
SCHEMBL6701233 0.89 POLA1 (0.57) F2KCNH2POLA1MEN1KMT2A
SCHEMBL6698845 0.88 POLA1 (0.56) F2KCNH2POLA1MEN1KMT2A
SCHEMBL6695736 0.86 KCNH2 (0.59) F2KCNH2POLA1MEN1KMT2A
SCHEMBL6696192 0.85 KCNH2 (0.52) F2KCNH2POLA1MEN1KMT2A
SCHEMBL6694680 0.85 POLA1 (0.60) F2KCNH2POLA1MEN1KMT2A
SCHEMBL6697748 0.85 KCNH2 (0.58) F2KCNH2POLA1MEN1KMT2A

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
US-20040186131-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-09-23 US claimed
US-6248739-B1 DNA POLYMERASE INHIBITORS EFFECTIVE AGAINST HERPESVIRUSES PHARMACIA & UPJOHN COMPANY 2001-06-19 US claimed
US-20040186131-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-09-23 US disclosed
US-6248739-B1 DNA POLYMERASE INHIBITORS EFFECTIVE AGAINST HERPESVIRUSES PHARMACIA & UPJOHN COMPANY 2001-06-19 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-20040186131-A1 Method of preventing or treating atherosclerosis or restenosis LDLR, NR1H3, NR1H2 F2 555/4885KCNH2 4383/4885POLA1 2550/4885

“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.