SCHEMBL12894823

SCHEMBL12894823

NNC(=O)c1ccccc1N=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 2/20 0.50
▸ CA1 P00915 1/20 0.50
▸ CA2 P00918 1/20 0.50
▸ CA9 Q16790 1/20 0.50
▸ ALDH1A1 P00352 8/20 0.49
▸ MAPT P10636 4/20 0.46
▸ GAA P10253 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MITF O75030 1/20 0.46
▸ NCOA1 Q15788 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ NCOA3 Q9Y6Q9 1/20 0.46
▸ P2RX7 Q99572 1/20 0.44
▸ GFER P55789 2/20 0.40
▸ MAOB P27338 1/20 0.40
▸ KDM4E B2RXH2 4/20 0.40
▸ HPGD P15428 4/20 0.40
▸ LMNA P02545 1/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.39

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
SCHEMBL2870231 0.86 CTSD (0.52) CTSDCA1CA2CA9ALDH1A1
SCHEMBL16977971 0.82 CTSD (0.49) CTSDCA1CA2CA9ALDH1A1
SCHEMBL30547074 0.80 CTSD (0.63) CTSDCA1CA2CA9ALDH1A1
SCHEMBL239328 0.80 CTSD (0.63) CTSDCA1CA2CA9ALDH1A1
SCHEMBL14718066 0.79 MEN1 (0.43) ALDH1A1MAPTMEN1KMT2ATDP1
Hydrochloric Acid SCHEMBL6692325 0.78 CTSD (0.61) CTSDCA1CA2CA9ALDH1A1
Hydroxyamine SCHEMBL14300671 0.78 CTSD (0.61) CTSDCA1CA2CA9ALDH1A1
Hydrazine SCHEMBL14300720 0.78 CTSD (0.61) CTSDCA1CA2CA9ALDH1A1
SCHEMBL14060235 0.78 F2R (0.53) CTSDCA1CA2CA9ALDH1A1
SCHEMBL840117 0.77 ALDH1A1 (0.61) ALDH1A1MAPTGAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200299282-A1 COMPOUNDS AND METHODS FOR TREATING CANCER ANTIDOTE IP HOLDINGS LLC (US) 2020-09-24 — — US disclosed
US-9783491-B2 Quinone derivative and electrophotographic photosensitive member KYOCERA DOCUMENTS SOLUTIONS INC. (JP) 2017-10-10 — — US disclosed
US-20110039847-A1 AMIDE DERIVATIVES AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC (US) 2011-02-17 — — 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 (2 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-20110039847-A1 AMIDE DERIVATIVES AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 CTSD 2170/4885CA1 4687/4885CA2 4035/4885
US-20200299282-A1 COMPOUNDS AND METHODS FOR TREATING CANCER VHL, TP53, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 CTSD 598/4885CA1 704/4885CA2 417/4885

“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.

Send feedback