SCHEMBL6401980

SCHEMBL6401980

CC(C)CCN(C(=O)OCc1ccccc1)C(=O)N(CCCc1ccccc1)CS(=O)(=O)Nc1cccc([C@H](C)O)c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
CACNA1H O95180 1/20 0.40
BACE1 P56817 4/20 0.38
NAMPT P43490 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CCR6 P51684 1/20 0.35
PAX8 Q06710 1/20 0.35
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
MAPT P10636 1/20 0.33
PPARG P37231 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAP1LC3B Q9GZQ8 1/20 0.33
MAP1LC3A Q9H492 1/20 0.33

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
SCHEMBL6401745 1.00 LMNA (0.45) LMNACACNA1HBACE1NAMPTMEN1
SCHEMBL6403038 0.89 CACNA1H (0.41) LMNACACNA1HMEN1KMT2AMAPT
SCHEMBL6407165 0.84 CA1 (0.40)
SCHEMBL6401746 0.79 LMNA (0.42) LMNACACNA1HPPARG
SCHEMBL6401744 0.78 LMNA (0.38) LMNACACNA1HBACE1OPRM1OPRD1
SCHEMBL6404595 0.76 LMNA (0.48) LMNANAMPTMEN1KMT2AMAPT
SCHEMBL7253037 0.75 LMNA (0.46) LMNANAMPTMEN1KMT2APPARG
SCHEMBL6404601 0.75 LMNA (0.46) LMNANAMPTMEN1KMT2AOPRM1
SCHEMBL6408728 0.74 AR (0.41) KMT2AMAPT
SCHEMBL6401373 0.74 MMP3 (0.40) KMT2A

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-6900237-B2 Sulfonamide compounds as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-05-31 US disclosed
US-20030158231-A1 Sulfonamide compounds as protease inhibitors Celera Corporation 2003-08-21 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-20030158231-A1 Sulfonamide compounds as protease inhibitors PRSS1, PRSS3, SPINT2 LMNA 3804/4885CACNA1H 2723/4885BACE1 130/4885

“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.