SCHEMBL353031

SCHEMBL353031

CC(CCOc1ccccc1)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.53
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
HPGD P15428 1/20 0.49
ALDH1A1 P00352 1/20 0.48
HTT P42858 2/20 0.48
GAA P10253 1/20 0.48
MTNR1A P48039 1/20 0.47
MTNR1B P49286 1/20 0.47
PKM P14618 1/20 0.47
PPARG P37231 1/20 0.47
PPARA Q07869 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46
LMNA P02545 1/20 0.46
TAAR1 Q96RJ0 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
SCHEMBL1716121 0.86 MAPK1 (0.53) PARP10MAPK1TDP1HPGDALDH1A1
SCHEMBL13235836 0.84 MTNR1A (0.53) PARP10MAPK1TDP1HPGDALDH1A1
SCHEMBL10612565 0.82 LMNA (0.58) PARP10MTNR1AMTNR1BPPARGPPARA
SCHEMBL6809829 0.82 LMNA (0.58) PARP10MTNR1AMTNR1BPPARGPPARA
SCHEMBL28991809 0.80 PARP10 (0.50) PARP10MAPK1TDP1HPGDALDH1A1
SCHEMBL28262129 0.80 TDP1 (0.51) MAPK1TDP1HPGDALDH1A1MTNR1A
SCHEMBL6200075 0.80 PPARG (0.51) PARP10MAPK1TDP1HPGDALDH1A1
SCHEMBL16932500 0.80 TDP1 (0.48) PARP10MAPK1TDP1HPGDALDH1A1
SCHEMBL6920635 0.77 TDP1 (0.59) PARP10MAPK1TDP1HPGDALDH1A1
SCHEMBL3434670 0.77 LMNA (0.57) MAPK1TDP1ALDH1A1GAAPKM

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-8148380-B2 Antibacterial amide and sulfonamide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-04-03 US disclosed
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2012-01-19 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-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds NAAA, AADAC, RPSA PARP10 3681/4885MAPK1 3630/4885TDP1 4434/4885

“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.