SCHEMBL3301412

SCHEMBL3301412

CC(C)(C)C(C(=O)O)N(c1ccc2c(ccn2-c2ccc(N3CCOCC3)nn2)c1)S(=O)(=O)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.36
HSD17B10 Q99714 2/20 0.36
LMNA P02545 1/20 0.36
CNR2 P34972 3/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PKM P14618 1/20 0.34
CCR9 P51686 1/20 0.33
ACLY P53396 1/20 0.33
POLB P06746 1/20 0.31
RAB9A P51151 4/20 0.31
NPC1 O15118 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL3295496 0.92 CCR9 (0.35) KDM4EHSD17B10LMNACNR2CCR9
SCHEMBL3303744 0.91
SCHEMBL3303822 0.90 HTR2C (0.31) LMNAL3MBTL1RAB9ANPC1KMT2A
SCHEMBL3299215 0.90 CNR2 (0.33) CNR2
SCHEMBL3297345 0.90 ACLY (0.36) KDM4EHSD17B10LMNACNR2L3MBTL1
SCHEMBL3298087 0.89
SCHEMBL3365596 0.89 DGAT1 (0.30)
SCHEMBL3302802 0.89 ACLY (0.40) L3MBTL1PKMACLYKMT2A
SCHEMBL3300694 0.88 ACLY (0.36) L3MBTL1CCR9ACLY
SCHEMBL3297361 0.88 KDM4E (0.36) KDM4EHSD17B10LMNACNR2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 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-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS PYGL, PYGM, G6PC1 KDM4E 620/4885HSD17B10 2472/4885LMNA 1244/4885

“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.