SCHEMBL22181863

SCHEMBL22181863

Nc1ccc(NCCCN2C(=O)c3cccc4cccc(c34)C2=O)c2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.58
▸ POLB P06746 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ TLR9 Q9NR96 2/20 0.58
▸ MAPT P10636 2/20 0.58
▸ RGS12 O14924 1/20 0.58
▸ USP2 O75604 1/20 0.58
▸ MAPK1 P28482 1/20 0.58
▸ HTT P42858 1/20 0.58
▸ ATM Q13315 1/20 0.58
▸ NPSR1 Q6W5P4 1/20 0.58
▸ TDP1 Q9NUW8 1/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ SIRT1 Q96EB6 3/20 0.55
▸ HEXA P06865 5/20 0.53
▸ HEXB P07686 5/20 0.53
▸ HDAC1 Q13547 3/20 0.52
▸ HDAC6 Q9UBN7 3/20 0.52
▸ HDAC3 O15379 2/20 0.52
▸ HDAC7 Q8WUI4 2/20 0.52

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
SCHEMBL22181921 0.94 SIRT1 (0.56) MEN1POLBKMT2ATLR9MAPT
SCHEMBL29632727 0.94 SIRT1 (0.56) MEN1POLBKMT2ATLR9MAPT
SCHEMBL22181920 0.87 SIRT1 (0.61) MEN1POLBKMT2ATLR9MAPT
SCHEMBL22181909 0.83 SIRT1 (0.57) MEN1POLBKMT2ATLR9MAPT
SCHEMBL22181918 0.83 SIRT1 (0.60) MEN1POLBKMT2ATLR9MAPT
SCHEMBL22181988 0.82 SIRT1 (0.53) MEN1POLBKMT2ATLR9MAPT
SCHEMBL22181862 0.81 MEN1 (0.53) MEN1POLBKMT2ATLR9MAPT
SCHEMBL22182108 0.81 USP2 (0.41) MEN1POLBKMT2ATLR9MAPT
SCHEMBL22181933 0.81 SIRT1 (0.54) MEN1POLBKMT2ATLR9MAPT
SCHEMBL22182111 0.80 HDAC1 (0.40) MEN1POLBKMT2ATLR9MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220143005-A1 NAPHTHALIMIDE DERIVATIVES AS ANTI-PARASITIC AGENTS FOR THE TREATMENT OF LEISHMANIASIS AS WELL AS VIRAL, BACTERIAL AND NEOPLASTIC DISEASES ISTANBUL MEDIPOL UNIVERSITESI (TR) 2022-05-12 — — US disclosed
WO-2020139291-A1 NAPHTHALIMIDE DERIVATIVES AS ANTI-PARASITIC AGENTS FOR THE TREATMENT OF LEISHMANIASIS AS WELL AS VIRAL, BACTERIAL AND NEOPLASTIC DISEASES ISTANBUL MEDIPOL UNIVERSITESI (TR) 2020-07-02 — — WO 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-20220143005-A1 NAPHTHALIMIDE DERIVATIVES AS ANTI-PARASITIC AGENTS FOR THE TREATMENT OF LEISHMANIASIS AS WELL AS VIRAL, BACTERIAL AND NEOPLASTIC DISEASES NPM1, ECI1, IPO5 MEN1 1430/4885POLB 625/4885KMT2A 2226/4885

“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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