SCHEMBL6970356

SCHEMBL6970356

CNC(=O)c1cc(Cl)nc(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.47
ALDH1A1 P00352 1/20 0.47
S1PR2 O95136 2/20 0.47
BRD4 O60885 1/20 0.46
HDAC8 Q9BY41 2/20 0.43
HDAC6 Q9UBN7 2/20 0.43
HDAC2 Q92769 1/20 0.43
PLK1 P53350 4/20 0.42
BCHE P06276 2/20 0.42
ACHE P22303 2/20 0.42
PLAU P00749 1/20 0.42
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
TAS1R2 Q8TE23 1/20 0.39
RAF1 P04049 1/20 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
SCHEMBL30737501 0.88 SLC6A3 (0.43) HPGDALDH1A1S1PR2BRD4HDAC8
SCHEMBL21383742 0.88 SLC6A3 (0.43) HPGDALDH1A1S1PR2BRD4HDAC8
SCHEMBL23060397 0.86 S1PR2 (0.50) S1PR2BCHEACHEHTTMEN1
SCHEMBL26624247 0.80 SLC6A3 (0.43) HPGDALDH1A1S1PR2BCHEACHE
SCHEMBL9382590 0.79 S1PR2 (0.44) S1PR2BRD4BCHEACHETSHR
SCHEMBL6402681 0.78 KDM4E (0.52) ALDH1A1S1PR2BCHEACHEHTT
SCHEMBL31312412 0.78 S1PR2 (0.42) HPGDALDH1A1S1PR2BRD4HDAC8
SCHEMBL6970353 0.78 S1PR2 (0.47) ALDH1A1S1PR2BCHEACHEHTT
SCHEMBL4478521 0.78 HDAC8 (0.60) HPGDALDH1A1BRD4HDAC8HDAC6
SCHEMBL1591897 0.78 POLB (0.46) ALDH1A1S1PR2BCHEACHETSHR

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 5 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
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP 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 HPGD 2643/4885ALDH1A1 867/4885S1PR2 1009/4885
US-20100113371-A9 Derivatives Of Pentose Monosaccharides As Anti-Inflammatory Compounds HLA-DRB1, IL5, TNF HPGD 2643/4885ALDH1A1 867/4885S1PR2 1009/4885

“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.