SCHEMBL6095722

SCHEMBL6095722

CC(C)CCC(N1CCCC(c2ccco2)C1)S(=O)(=O)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.37
POLB P06746 4/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TSHR P16473 1/20 0.37
DRD2 P14416 2/20 0.37
HTR7 P34969 2/20 0.37
CHRM2 P08172 3/20 0.36
CHRM4 P08173 3/20 0.36
CHRM5 P08912 3/20 0.36
CHRM1 P11229 3/20 0.36
CHRM3 P20309 3/20 0.36
HSD17B10 Q99714 3/20 0.35
ALOX15 P16050 2/20 0.35
MAPK1 P28482 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAPT P10636 4/20 0.34
KDM4E B2RXH2 3/20 0.34
RECQL P46063 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 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
SCHEMBL6096509 0.85 DRD2 (0.54) ALDH1A1SMN1; SMN2DRD2HTR7HSD17B10
SCHEMBL6098434 0.82 DRD2 (0.37) ALDH1A1DRD2HTR7KDM4EHTR1A
Hydrochloric Acid SCHEMBL6096699 0.80 DRD2 (0.33) ALDH1A1SMN1; SMN2TSHRDRD2HTR7
SCHEMBL6099635 0.79 LMNA (0.45) ALDH1A1POLBSMN1; SMN2TSHRDRD2
SCHEMBL6095467 0.79 RORC (0.46) ALDH1A1SMN1; SMN2HSD17B10MAPTKDM4E
SCHEMBL6098065 0.78 ALDH1A1 (0.47) ALDH1A1DRD2HTR7CHRM5MAPT
SCHEMBL6095903 0.78 CCR5 (0.40) DRD2HTR7HTR1AHTR1BHTR2A
SCHEMBL6099287 0.78 KDM4E (0.33) ALDH1A1SMN1; SMN2DRD2HTR7HSD17B10
SCHEMBL6097202 0.78 AVPR1A (0.34) ALDH1A1POLBSMN1; SMN2TSHRDRD2
SCHEMBL6096322 0.78 CCR5 (0.43) DRD2HTR7HTR1AHTR1BHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040229864-A1 Sulfone derivatives as 5-HT7 receptor ligands MERCK SHARP & DOHME LTD. (GB) 2004-11-18 US claimed
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 ALDH1A1 1138/4885POLB 4156/4885SMN1; SMN2 1794/4885

“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.