SCHEMBL5999032

SCHEMBL5999032

CC1=Cc2c(C)nn(S(=O)(=O)c3ccc(C)cc3)c2C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.49
POLB P06746 2/20 0.48
KMT2A Q03164 6/20 0.47
MEN1 O00255 5/20 0.47
ALDH1A1 P00352 3/20 0.47
LMNA P02545 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
NR1H2 P55055 1/20 0.42
NR1H3 Q13133 1/20 0.42
PKM P14618 3/20 0.41
MMP2 P08253 1/20 0.41
HTT P42858 1/20 0.41
ALDH3A1 P30838 1/20 0.40
SLC9A1 P19634 1/20 0.40
GAA P10253 2/20 0.40
KDM4E B2RXH2 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CXCL8 P10145 1/20 0.39
NOD2 Q9HC29 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
SCHEMBL5535665 0.82 MEN1 (0.48) MAPTPOLBKMT2AMEN1ALDH1A1
SCHEMBL5056157 0.69 POLB (0.56) MAPTPOLBKMT2AMEN1ALDH1A1
SCHEMBL17942372 0.69 POLB (0.52) MAPTPOLBKMT2AMEN1ALDH1A1
SCHEMBL5530256 0.68 MEN1 (0.47) MAPTPOLBKMT2AMEN1ALDH1A1
SCHEMBL5062898 0.68 POLB (0.55) MAPTPOLBKMT2AMEN1ALDH1A1
SCHEMBL28720779 0.68 POLB (0.70) MAPTPOLBKMT2AMEN1ALDH1A1
SCHEMBL19759447 0.67 POLB (0.53) MAPTPOLBKMT2AMEN1ALDH1A1
SCHEMBL12253486 0.67 SLC9A1 (0.56) MAPTPOLBKMT2AMEN1ALDH1A1
SCHEMBL12797057 0.67 POLB (0.53) MAPTPOLBKMT2AMEN1ALDH1A1
SCHEMBL14678362 0.66 POLB (0.52) MAPTPOLBKMT2AMEN1ALDH1A1

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-8637555-B2 Tetrazole derivatives and methods of treatment of metabolic-related disorders thereof ARENA PHARMACEUTICALS, INC. (US) 2014-01-28 US disclosed
US-20060217562-A1 Tetrazole derivatives and methods of treatment of metabolic-related disorders thereof ARENA PHARMACEUTICALS, INC. 2006-09-28 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-20060217562-A1 Tetrazole derivatives and methods of treatment of metabolic-related disorders thereof SQLE, ACE, AGTR2 MAPT 3561/4885POLB 4002/4885KMT2A 4044/4885

“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.