SCHEMBL12660533

SCHEMBL12660533

NCCCNCCN1C(=O)c2cccc3c(N)ccc(c23)C1=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 4/20 0.58
▸ NFE2L2 Q16236 4/20 0.58
▸ TLR9 Q9NR96 1/20 0.58
▸ SIRT1 Q96EB6 3/20 0.58
▸ USP2 O75604 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ ATM Q13315 2/20 0.58
▸ CYP1B1 Q16678 2/20 0.58
▸ HEXA P06865 3/20 0.55
▸ HEXB P07686 3/20 0.55
▸ OGA O60502 1/20 0.55
▸ DYRK3 O43781 1/20 0.51
▸ RPS6KB1 P23443 1/20 0.51
▸ EPHA2 P29317 1/20 0.51
▸ FLT4 P35916 1/20 0.51
▸ CSNK2A1 P68400 1/20 0.51
▸ KDM4E B2RXH2 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ MAPT P10636 2/20 0.49

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
SCHEMBL12660542 0.94 SIRT1 (0.66) KEAP1NFE2L2TLR9SIRT1USP2
SCHEMBL12660534 0.91 KEAP1 (0.60) KEAP1NFE2L2TLR9SIRT1USP2
SCHEMBL13964867 0.87 KMT2A (0.67) KEAP1NFE2L2TLR9USP2KMT2A
SCHEMBL29086656 0.85 HEXA (0.67) KEAP1NFE2L2TLR9USP2KMT2A
SCHEMBL12660568 0.84 SIRT1 (0.54) KEAP1NFE2L2TLR9SIRT1USP2
SCHEMBL13964866 0.84 USP2 (0.70) KEAP1NFE2L2TLR9USP2KMT2A
SCHEMBL3290712 0.82 SIRT1 (0.86) SIRT1HEXAHEXBOGA
SCHEMBL3292141 0.82 SIRT1 (0.81) SIRT1HEXAHEXBOGA
SCHEMBL9093307 0.81 SIRT1 (0.60) TLR9SIRT1USP2KMT2AMEN1
SCHEMBL9091826 0.81 KDM4E (0.59) TLR9SIRT1USP2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7947839-B2 Heterocyclic-substituted bis-1,8 naphthalimide compounds, antibody drug conjugates, and methods of use GENENTECH, INC. (US) 2011-05-24 — — US disclosed
US-7947839-B2 Heterocyclic-substituted bis-1,8 naphthalimide compounds, antibody drug conjugates, and methods of use GENENTECH, INC. (US) 2011-05-24 — — US disclosed
WO-2007064345-A9 HETEROCYCLIC-SUBSTITUTED BIS-1,8 NAPHTHALIMIDE COMPOUNDS, ANTIBODY DRUG CONJUGATES, AND METHODS OF USE GENENTECH INC (US) 2007-07-12 — — WO disclosed
US-20070134243-A1 Antibody drug conjugates and methods GENENTECH, INC. 2007-06-14 — — US disclosed
US-20070134243-A1 Antibody drug conjugates and methods GENENTECH, INC. 2007-06-14 — — 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-20070134243-A1 Antibody drug conjugates and methods BOD1L1, MKI67, CCNI KEAP1 1373/4885NFE2L2 2213/4885TLR9 2646/4885

“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.

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