SCHEMBL16503516

SCHEMBL16503516

CC(C)OC(=O)C[C@H](/C=C/c1ccccc1)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
MAPT P10636 1/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
BACE1 P56817 1/20 0.34
BTN3A1 O00481 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
LMNA P02545 1/20 0.34
PRNP P04156 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
SCHEMBL16503528 0.78 TSHR (0.39) TSHRMEN1KMT2AMAPTBTN3A1
SCHEMBL437879 0.77 MEN1 (0.48) MEN1KMT2ACYP1A2BACE1
SCHEMBL16503522 0.76 TSHR (0.44) TSHRMEN1KMT2AMAPTHPGD
SCHEMBL16503510 0.76 TSHR (0.44) TSHRMEN1KMT2AMAPTHPGD
SCHEMBL16503520 0.74 KMT2A (0.39) MEN1KMT2ACYP1A2BACE1
SCHEMBL7724629 0.74 CYP1A2 (0.44) TSHRMEN1KMT2AMAPTCYP1A2
SCHEMBL7724626 0.74 CYP1A2 (0.44) TSHRMEN1KMT2AMAPTCYP1A2
SCHEMBL16503526 0.72 TSHR (0.47) TSHRMEN1KMT2AMAPTHPGD
SCHEMBL11899615 0.71 CYP3A4 (0.38) MEN1KMT2AMAPTCYP1A2HPGD
SCHEMBL11899259 0.71 MEN1 (0.36) MEN1KMT2AMAPTCYP1A2HPGD

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-9079869-B2 Chiral disulfonimides STUDIENGESELLSCHAFT KOHLE MBH (DE) 2015-07-14 US disclosed
US-20110313150-A1 CHIRAL DISULFONIMIDES STUDIENGESELLSCHAFT KOHLE MBH (DE) 2011-12-22 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-20110313150-A1 CHIRAL DISULFONIMIDES STS, SUDS3, SF1 TSHR 4279/4885MEN1 1578/4885KMT2A 3397/4885

“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.