SCHEMBL6098896

SCHEMBL6098896

CC(C)CCC(N1CCC=C(c2cccs2)C1)S(=O)(=O)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VDR P11473 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TP53 P04637 2/20 0.36
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 4/20 0.35
TSHR P16473 2/20 0.35
THRB P10828 1/20 0.34
LMNA P02545 3/20 0.33
POLB P06746 1/20 0.33
CCR5 P51681 1/20 0.33
MAPT P10636 3/20 0.33
HTT P42858 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HSD17B10 Q99714 1/20 0.33
OPRD1 P41143 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
RORC P51449 2/20 0.32
GBA1 P04062 1/20 0.32

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
SCHEMBL6099117 0.85 HSD11B1 (0.40) ALDH1A1KDM4ETSHRRORC
SCHEMBL6096318 0.81 KDM4E (0.35) ALDH1A1KDM4ETSHROPRD1RORC
SCHEMBL6097610 0.79 KMT2A (0.37) ALDH1A1KDM4ETSHRPOLBMAPT
SCHEMBL6097361 0.78 RORC (0.33) KDM4ERORC
SCHEMBL6096437 0.78 HSD11B1 (0.47) SMN1; SMN2ALDH1A1LMNAPOLBMAPT
SCHEMBL6097308 0.78 MMP2 (0.37) SMN1; SMN2ALDH1A1POLBMAPTSLC6A3
SCHEMBL6097994 0.76 HSD11B1 (0.40) SMN1; SMN2TP53ALDH1A1KDM4ETSHR
SCHEMBL6097980 0.72 KDM4E (0.36) ALDH1A1KDM4ETSHRLMNAMAPT
SCHEMBL6097283 0.72 MEN1 (0.46) ALDH1A1KDM4ETSHRLMNAMAPT
SCHEMBL6099635 0.71 LMNA (0.45) SMN1; SMN2ALDH1A1KDM4ETSHRLMNA

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 VDR 391/4885SMN1; SMN2 1794/4885TP53 4836/4885

“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.