SCHEMBL6702229

SCHEMBL6702229

O=C(NCc1ccc(Cl)cc1)c1cn(-c2ccccc2)c2ccc(CC3CCOCC3)cc2c1=O

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
F2 P00734 1/20 0.49
MAPK8 P45983 4/20 0.46
KCNH2 Q12809 5/20 0.46
MAPT P10636 3/20 0.45
LMNA P02545 1/20 0.45
POLA1 P09884 2/20 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
SCHEMBL6697765 0.86 MEN1 (0.67) MEN1KMT2AF2KCNH2MAPT
SCHEMBL6697784 0.85 KCNH2 (0.59) MEN1KMT2AF2MAPK8KCNH2
SCHEMBL6699355 0.85 MEN1 (0.48) MEN1KMT2AF2KCNH2MAPT
SCHEMBL6709492 0.81 KCNH2 (0.61) MEN1KMT2AF2KCNH2MAPT
SCHEMBL6699089 0.81 PLA2G4A (0.49) MEN1KMT2AMAPTLMNA
SCHEMBL6699871 0.79 KCNH2 (0.60) MEN1KMT2AF2MAPK8KCNH2
SCHEMBL6703017 0.78 MAPT (0.47) MEN1KMT2AMAPK8MAPTLMNA
SCHEMBL6724249 0.78 POLA1 (0.48) MEN1KMT2AF2KCNH2POLA1
SCHEMBL6698795 0.78 KCNH2 (0.56) MEN1KMT2AF2KCNH2MAPT
SCHEMBL6704232 0.78 KCNH2 (0.54) MEN1KMT2AF2MAPK8KCNH2

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-20040186131-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-09-23 US claimed
US-6653307-B2 Such as N-(4-chlorobenzyl)-6-(4-morpholinylmethyl)-4-oxo-1-phenyl-1,4-dihydro-3-quinolinecarboxamide for treatment of herpes virus; viral DNA polymerase inhibitors PHARMACIA & UPJOHN COMPANY 2003-11-25 US claimed
US-20020103220-A1 1-Aryl-4oxo-1,4-Dihydro-3-quinolinecarboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-08-01 US claimed
US-20040186131-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-09-23 US disclosed
US-20040024209-A1 1-Aryl-4-oxo-1,4-dihydro-3-quinolinecarboxamides as antiviral agents SCHNUTE MARK E (US) 2004-02-05 US disclosed
US-6653307-B2 Such as N-(4-chlorobenzyl)-6-(4-morpholinylmethyl)-4-oxo-1-phenyl-1,4-dihydro-3-quinolinecarboxamide for treatment of herpes virus; viral DNA polymerase inhibitors PHARMACIA & UPJOHN COMPANY 2003-11-25 US disclosed
US-20020103220-A1 1-Aryl-4oxo-1,4-Dihydro-3-quinolinecarboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-08-01 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 (3 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-20040024209-A1 1-Aryl-4-oxo-1,4-dihydro-3-quinolinecarboxamides as antiviral agents ZC3HAV1, ZC3HAV1L, IRF3 MEN1 3424/4885KMT2A 2607/4885F2 4770/4885
US-20040186131-A1 Method of preventing or treating atherosclerosis or restenosis LDLR, NR1H3, NR1H2 MEN1 3030/4885KMT2A 4688/4885F2 555/4885
US-20020103220-A1 1-Aryl-4oxo-1,4-Dihydro-3-quinolinecarboxamides as antiviral agents ZC3HAV1, IRF3, ZC3HAV1L MEN1 3558/4885KMT2A 2166/4885F2 4745/4885

“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.