SCHEMBL4906187

SCHEMBL4906187

CCc1ccc(S(=O)(=O)N(CC)c2csc(-c3ccc(C(C)(C)C)cc3)n2)cc1C(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.39
HDAC3 O15379 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
TP53 P04637 3/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 4/20 0.36
KDM4E B2RXH2 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
NFKB1 P19838 1/20 0.36
RAB9A P51151 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
NR1I2 O75469 3/20 0.35
HCRTR2 O43614 1/20 0.35
MEN1 O00255 2/20 0.34

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
SCHEMBL4908323 0.91 NR1I2 (0.40) ALDH1A1TSHRHDAC3HDAC11HDAC8
SCHEMBL4905858 0.90 LMNA (0.40) ALDH1A1HDAC3HDAC11HDAC8HDAC6
SCHEMBL4897618 0.90 TP53 (0.42) ALDH1A1TSHRTP53GAAMAPT
SCHEMBL4900527 0.89 MAPT (0.41) ALDH1A1TSHRTP53GAAMAPT
SCHEMBL4900904 0.87 NR1I2 (0.36) ALDH1A1TSHRHDAC3HDAC11HDAC8
SCHEMBL4906177 0.84 ALDH1A1 (0.38) ALDH1A1TSHRHDAC3HDAC11HDAC8
SCHEMBL4906002 0.83 ALDH1A1 (0.39) ALDH1A1TSHRHDAC3HDAC11HDAC8
SCHEMBL4902609 0.83 TP53 (0.43) ALDH1A1TSHRHDAC3HDAC11HDAC8
SCHEMBL4895921 0.83 LMNA (0.40) ALDH1A1HDAC3HDAC11HDAC8HDAC6
SCHEMBL4902470 0.81 TP53 (0.43) ALDH1A1TSHRTP53GAAMAPT

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-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER INC. 2008-04-17 US disclosed
US-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds HAMANAKA ERNEST S 2006-10-12 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-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds PPARA, PPARG, PPARD ALDH1A1 2664/4885TSHR 412/4885HDAC3 176/4885
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PPARA, PPARG, PPARD ALDH1A1 2956/4885TSHR 400/4885HDAC3 157/4885

“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.