SCHEMBL13329804

SCHEMBL13329804

CNC(=O)Cc1ccc(C(C)C)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.58
NLRP3 Q96P20 1/20 0.55
HTT P42858 1/20 0.51
HDAC1 Q13547 2/20 0.49
HDAC6 Q9UBN7 2/20 0.49
CACNA1H O95180 4/20 0.47
CACNA1G O43497 2/20 0.47
CACNA1I Q9P0X4 2/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
ALDH1A1 P00352 2/20 0.46
BCHE P06276 1/20 0.46
ACHE P22303 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
SCHEMBL13557883 0.85 CNR2 (0.58) CNR2NLRP3HTTHDAC1HDAC6
SCHEMBL23553286 0.83 CNR2 (0.66) CNR2NLRP3HTTCACNA1HCACNA1G
SCHEMBL30545033 0.83 CNR2 (0.57) CNR2NLRP3HTTHDAC1HDAC6
SCHEMBL28522649 0.81 CXCR1 (0.50) HPGDLMNA
SCHEMBL26078963 0.80 HPGD (0.73) CNR2NLRP3HTTHDAC1HDAC6
SCHEMBL1632446 0.80 LMNA (0.51) CNR2HTTHDAC6HDAC4HDAC8
SCHEMBL6244680 0.80 POLB (0.67) CNR2HTTALDH1A1L3MBTL1POLB
SCHEMBL11398700 0.79 CNR2 (0.51) CNR2NLRP3HTTHDAC1HDAC6
SCHEMBL14724727 0.79 CNR2 (0.49) CNR2NLRP3HTTHDAC4HDAC2
SCHEMBL17658918 0.79 HPGD (0.55) CNR2NLRP3HTTHDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100113371-A9 Derivatives Of Pentose Monosaccharides As Anti-Inflammatory Compounds RANBAXY LABORATORIES LIMITED INC. (IN) 2010-05-06 US disclosed
US-20100113371-A9 Derivatives Of Pentose Monosaccharides As Anti-Inflammatory Compounds RANBAXY LABORATORIES LIMITED INC. (IN) 2010-05-06 US disclosed
US-20090075909-A1 Derivatives Of Pentose Monosaccharides As Anti-Inflammatory Compounds RANBAXY LABORATORIES LIMITED INC. (IN) 2009-03-19 US disclosed
US-20090075909-A1 Derivatives Of Pentose Monosaccharides As Anti-Inflammatory Compounds RANBAXY LABORATORIES LIMITED INC. (IN) 2009-03-19 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 (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-20090075909-A1 Derivatives Of Pentose Monosaccharides As Anti-Inflammatory Compounds HLA-DRB1, IL5, TNF CNR2 1770/4885NLRP3 308/4885HTT 2777/4885
US-20100113371-A9 Derivatives Of Pentose Monosaccharides As Anti-Inflammatory Compounds HLA-DRB1, IL5, TNF CNR2 1770/4885NLRP3 308/4885HTT 2777/4885

“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.