SCHEMBL6698620

SCHEMBL6698620

O=C(NCc1ccc(Cl)cc1)c1cn(CCN2CCOCC2)c2ccc(C=CCO)cc2c1=O

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.57
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
KCNH2 Q12809 5/20 0.53
POLA1 P09884 2/20 0.51
MAPT P10636 2/20 0.48
TP53 P04637 1/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
RECQL P46063 1/20 0.46
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46

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
SCHEMBL6698619 1.00 F2 (0.57) F2MEN1KMT2AKCNH2POLA1
SCHEMBL6698594 0.83 MAPT (0.61) MEN1KMT2AKCNH2MAPTTP53
SCHEMBL6698601 0.83 MAPT (0.61) MEN1KMT2AKCNH2MAPTTP53
SCHEMBL6702921 0.83 MAPT (0.61) MEN1KMT2AKCNH2MAPTTP53
SCHEMBL6698734 0.82 F2 (0.57) F2MEN1KMT2AKCNH2POLA1
SCHEMBL6694680 0.80 POLA1 (0.60) F2MEN1KMT2AKCNH2POLA1
SCHEMBL6697351 0.79 KCNH2 (0.59) F2MEN1KMT2AKCNH2POLA1
SCHEMBL6693197 0.78 KCNH2 (0.59) F2MEN1KMT2AKCNH2POLA1
SCHEMBL6697203 0.78 F2 (0.59) F2MEN1KMT2AKCNH2POLA1
SCHEMBL6668294 0.77 POLA1 (0.59) F2MEN1KMT2AKCNH2POLA1

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 555/4885MEN1 3030/4885KMT2A 4688/4885

“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.