SCHEMBL6097919

SCHEMBL6097919

CC#CC(=O)C1CCCN(C(CCC(C)C)S(=O)(=O)c2ccccc2)C1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 2/20 0.36
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 1/20 0.36
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL6099714 0.85 KMT2A (0.50) CYP2C19KMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL6097394 0.83 CYP2C19 (0.39) CYP2C19KMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL6098988 0.82 CYP2C19 (0.41) CYP2C19KMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL6096991 0.81 KDM4E (0.34) CYP2C19KMT2ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL6095467 0.80 RORC (0.46) CYP2C19KMT2ASMN1; SMN2ALDH1A1GAA
SCHEMBL6097159 0.80 CYP2D6 (0.35) CYP2C19KMT2ASMN1; SMN2ALDH1A1USP2
SCHEMBL6095708 0.79 CYP2C19 (0.38) CYP2C19KMT2AALDH1A1USP2GAA
SCHEMBL6095436 0.78 CYP2C19 (0.41) CYP2C19KMT2ASMN1; SMN2ALDH1A1GAA
SCHEMBL6097245 0.78 RORC (0.43) KMT2ASMN1; SMN2ALDH1A1GAAHSD17B10
Hydrochloric Acid SCHEMBL6097193 0.78 CYP2C19 (0.40) CYP2C19KMT2ASMN1; SMN2ALDH1A1GAA

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 CYP2C19 446/4885KMT2A 2168/4885LMNA 3190/4885

“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.