SCHEMBL22181920

SCHEMBL22181920

O=C1c2cccc3cccc(c23)C(=O)N1CCCNc1cccc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT1 Q96EB6 3/20 0.61
▸ MEN1 O00255 4/20 0.60
▸ KMT2A Q03164 4/20 0.60
▸ MAPT P10636 4/20 0.60
▸ POLB P06746 3/20 0.60
▸ HTT P42858 2/20 0.60
▸ RGS12 O14924 1/20 0.60
▸ USP2 O75604 1/20 0.60
▸ MAPK1 P28482 1/20 0.60
▸ ATM Q13315 1/20 0.60
▸ NPSR1 Q6W5P4 1/20 0.60
▸ TLR9 Q9NR96 1/20 0.60
▸ TDP1 Q9NUW8 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60
▸ HEXA P06865 5/20 0.57
▸ HEXB P07686 5/20 0.57
▸ OGA O60502 1/20 0.57
▸ CASP1 P29466 1/20 0.56
▸ NR1I2 O75469 1/20 0.52
▸ AHR P35869 1/20 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 0.88 SIRT1 (0.56) SIRT1MEN1KMT2AMAPTPOLB
SCHEMBL29632727 0.88 SIRT1 (0.56) SIRT1MEN1KMT2AMAPTPOLB
SCHEMBL22181863 0.87 MEN1 (0.58) SIRT1MEN1KMT2AMAPTPOLB
SCHEMBL22181933 0.86 SIRT1 (0.54) SIRT1MEN1KMT2AMAPTPOLB
SCHEMBL22181918 0.83 SIRT1 (0.60) SIRT1MEN1KMT2AMAPTPOLB
SCHEMBL22181862 0.82 MEN1 (0.53) SIRT1MEN1KMT2AMAPTPOLB
SCHEMBL22181909 0.81 SIRT1 (0.57) SIRT1MEN1KMT2AMAPTPOLB
SCHEMBL22181840 0.81 SIRT1 (0.57) SIRT1MEN1KMT2AMAPTPOLB
SCHEMBL13909959 0.80 SIRT1 (0.75) SIRT1MEN1KMT2AMAPTPOLB
SCHEMBL1672292 0.80 MEN1 (0.58) SIRT1MEN1KMT2AMAPTPOLB

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 SIRT1 2546/4885MEN1 1430/4885KMT2A 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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