SCHEMBL10030205

SCHEMBL10030205

Cc1cc(NC(=O)ON2C(=O)CCC2=O)c2ccccc2c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 1/20 0.40
MAPK14 Q16539 1/20 0.39
LMNA P02545 2/20 0.38
POLB P06746 2/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
CYP1A2 P05177 1/20 0.36
CYP2A6 P11509 1/20 0.36
KDM4E B2RXH2 1/20 0.36
RAB9A P51151 2/20 0.36
EPHX2 P34913 1/20 0.35
NPC1 O15118 1/20 0.35
CDC25B P30305 1/20 0.35
MAOB P27338 1/20 0.35
MDM2 Q00987 1/20 0.35

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
SCHEMBL10030202 0.90 HPGD (0.41) HPGDMEN1KMT2AHTTLMNA
SCHEMBL4402082 0.88 ALDH1A1 (0.45) HPGDALDH1A1MEN1KMT2AMAPK14
SCHEMBL10030203 0.83 POLB (0.39) HPGDALDH1A1MEN1KMT2AHTT
SCHEMBL4401959 0.83 ALDH1A1 (0.54) HPGDALDH1A1MEN1KMT2ALMNA
SCHEMBL4399516 0.80 HDAC1 (0.47) HPGDALDH1A1MEN1KMT2ALMNA
SCHEMBL10030204 0.80 LMNA (0.36) HPGDALDH1A1LMNAPOLBTP53
SCHEMBL4403976 0.77 ITGB1 (0.55) HPGDALDH1A1HTTPOLBMAPT
SCHEMBL20436305 0.77 ALDH1A1 (0.43) HPGDALDH1A1MEN1KMT2ALMNA
SCHEMBL10030212 0.75 ALDH1A1 (0.53) HPGDALDH1A1MEN1KMT2ATP53
SCHEMBL4399520 0.74 ALDH1A1 (0.54) HPGDALDH1A1MEN1KMT2AHTT

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-8124792-B2 Compounds and methods for rapid labeling of N-glycans PROZYME, INC. (US) 2012-02-28 US disclosed
US-20090258437-A1 COMPOUNDS AND METHODS FOR RAPID LABELING OF N-GLYCANS PROZYME, INC. (US) 2009-10-15 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-20090258437-A1 COMPOUNDS AND METHODS FOR RAPID LABELING OF N-GLYCANS B3GNT2, FUT5, FUT6 HPGD 2709/4885ALDH1A1 2931/4885MEN1 2451/4885

“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.