SCHEMBL6095467

SCHEMBL6095467

CC(C)CCC(N1CCCC(O)C1)S(=O)(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RORC P51449 9/20 0.46
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
CYP2C19 P33261 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SAE1 Q9UBE0 1/20 0.36
UBA2 Q9UBT2 1/20 0.36
PIK3CA P42336 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL6095436 0.86 CYP2C19 (0.41) RORCALDH1A1CYP2C19KMT2AMAPT
Hydrochloric Acid SCHEMBL6097193 0.85 CYP2C19 (0.40) RORCALDH1A1CYP2C19KMT2AMAPT
SCHEMBL6099714 0.84 KMT2A (0.50) RORCALDH1A1CYP2C19KMT2AMEN1
SCHEMBL6097394 0.84 CYP2C19 (0.39) ALDH1A1CYP2C19KMT2ASMN1; SMN2HSD17B10
SCHEMBL6097882 0.83 RORC (0.34) RORCALDH1A1KDM4ECYP2C19KMT2A
SCHEMBL6097057 0.83 RORC (0.41) RORCKDM4ECYP2C19HSD17B10
SCHEMBL6097505 0.83 RORC (0.34) RORCALDH1A1KDM4ECYP2C19KMT2A
SCHEMBL6098125 0.83 FABP6 (0.36) RORCALDH1A1KDM4E
SCHEMBL6097159 0.82 CYP2D6 (0.35) RORCALDH1A1KDM4ECYP2C19KMT2A
SCHEMBL6097245 0.82 RORC (0.43) RORCALDH1A1KDM4EKMT2AMEN1

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-7101892-B2 Sulfone derivatives as 5-HT7 receptor ligands MERCK SHARP & DOHME LTD. 2006-09-05 US disclosed
US-20040229864-A1 Sulfone derivatives as 5-HT7 receptor ligands MERCK SHARP & DOHME LTD. (GB) 2004-11-18 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-20040229864-A1 Sulfone derivatives as 5-HT7 receptor ligands HTR7, HTR2C, HTR1A RORC 669/4885ALDH1A1 1138/4885KDM4E 2306/4885

“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.