SCHEMBL24418166

SCHEMBL24418166

CCN(CC)C(=O)Nc1ccc(-c2ccc(NCCCN3C(=O)c4cccc5cccc(c45)C3=O)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.53
▸ MAPT P10636 2/20 0.53
▸ HPGD P15428 2/20 0.53
▸ THRB P10828 1/20 0.53
▸ KDM4E B2RXH2 5/20 0.50
▸ MEN1 O00255 4/20 0.50
▸ KMT2A Q03164 4/20 0.50
▸ SIRT1 Q96EB6 2/20 0.48
▸ HEXA P06865 2/20 0.48
▸ HEXB P07686 2/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ POLB P06746 2/20 0.46
▸ NR1I2 O75469 1/20 0.46
▸ AHR P35869 1/20 0.46
▸ RAD52 P43351 1/20 0.46
▸ RCE1 Q9Y256 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
SCHEMBL22181871 0.84 ALDH1A1 (0.55) ALDH1A1MAPTHPGDTHRBKDM4E
SCHEMBL22181895 0.82 ALDH1A1 (0.59) ALDH1A1MAPTHPGDTHRBKDM4E
SCHEMBL22182015 0.82 ALDH1A1 (0.53) ALDH1A1MAPTHPGDTHRBKDM4E
SCHEMBL22182098 0.82 SIRT1 (0.57) ALDH1A1MAPTHPGDTHRBKDM4E
SCHEMBL22181917 0.82 SIRT1 (0.57) ALDH1A1MAPTHPGDTHRBKDM4E
SCHEMBL22181858 0.82 ALDH1A1 (0.64) ALDH1A1MAPTHPGDTHRBKDM4E
SCHEMBL22181992 0.81 SIRT1 (0.52) ALDH1A1MAPTHPGDTHRBKDM4E
SCHEMBL22182010 0.81 SIRT1 (0.47) ALDH1A1MAPTHPGDTHRBKDM4E
SCHEMBL22181908 0.81 MEN1 (0.55) ALDH1A1MAPTHPGDTHRBKDM4E
SCHEMBL22181902 0.80 SIRT1 (0.57) ALDH1A1MAPTHPGDTHRBKDM4E

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 1 patent. 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

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 ALDH1A1 785/4885MAPT 4360/4885HPGD 1163/4885

“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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