SCHEMBL6698734

SCHEMBL6698734

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

nearest known ligand 0.63

Predicted protein targets (top 7)

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 0.53
MAPT P10636 1/20 0.48
TP53 P04637 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
SCHEMBL6667231 0.94 F2 (0.51) F2MEN1KMT2AKCNH2POLA1
SCHEMBL6670799 0.93 F2 (0.50) F2MEN1KMT2AKCNH2POLA1
SCHEMBL6670429 0.89 F2 (0.48) F2MEN1KMT2APOLA1MAPT
SCHEMBL6702706 0.88 MEN1 (0.52) F2MEN1KMT2AMAPT
SCHEMBL6666937 0.87 MEN1 (0.55) F2MEN1KMT2AMAPT
SCHEMBL7940984 0.84 MEN1 (0.55) F2MEN1KMT2AMAPT
SCHEMBL6697203 0.84 F2 (0.59) F2MEN1KMT2AKCNH2POLA1
SCHEMBL6698530 0.84 MEN1 (0.51) F2MEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL6699579 0.84 MEN1 (0.54) F2MEN1KMT2AMAPT
SCHEMBL6702174 0.84 MEN1 (0.54) F2MEN1KMT2AMAPT

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.