SCHEMBL3560739

SCHEMBL3560739

COc1ccc(S(=O)(=O)Nc2ccccc2CCCc2ccccc2C(=O)O)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.57
LMNA P02545 1/20 0.57
KEAP1 Q14145 1/20 0.54
NFE2L2 Q16236 1/20 0.54
CA12 O43570 1/20 0.53
CA9 Q16790 1/20 0.53
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
WDR5 P61964 2/20 0.53
SLC16A3 O15427 2/20 0.52
GAA P10253 2/20 0.50
KDM4E B2RXH2 4/20 0.49
ALDH1A1 P00352 3/20 0.49
MAPT P10636 1/20 0.49
HSD17B10 Q99714 1/20 0.49
RCE1 Q9Y256 1/20 0.48
HDAC1 Q13547 1/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.48

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
SCHEMBL3559521 0.97 SMN1; SMN2 (0.56) SMN1; SMN2LMNAKEAP1NFE2L2CA12
SCHEMBL3561138 0.96 SMN1; SMN2 (0.59) SMN1; SMN2LMNAKEAP1NFE2L2CA12
SCHEMBL3552935 0.87 SLC16A3 (0.68) SMN1; SMN2LMNAKEAP1NFE2L2CA12
SCHEMBL3557420 0.87 SLC16A3 (0.62) SMN1; SMN2LMNAKEAP1NFE2L2CA12
SCHEMBL3551774 0.86 LMNA (0.58) SMN1; SMN2LMNAKEAP1NFE2L2MEN1
SCHEMBL28784798 0.85 LMNA (0.68) SMN1; SMN2LMNAKEAP1NFE2L2CA12
SCHEMBL3560551 0.85 KEAP1 (0.54) KEAP1NFE2L2MEN1KMT2ASLC16A3
SCHEMBL3563389 0.84 MEN1 (0.76) SMN1; SMN2LMNAMEN1KMT2ASLC16A3
SCHEMBL3554581 0.83 KDM4E (0.54) MEN1KMT2ASLC16A3KDM4EALDH1A1
SCHEMBL3563777 0.83 LMNA (0.57) SMN1; SMN2LMNAKEAP1NFE2L2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7816397-B2 Phenylcarboxylic acid derivatives and use thereof for the treatment of diabetes MERCK PATENT GMBH (DE) 2010-10-19 US claimed
US-20080045483-A1 Phenylcarboxylic Acid Derivatives and Use Thereof for the Treatment of Diabetes MERCK PATENT GMBH (DE) 2008-02-21 US claimed
US-7816397-B2 Phenylcarboxylic acid derivatives and use thereof for the treatment of diabetes MERCK PATENT GMBH (DE) 2010-10-19 US disclosed
US-20080045483-A1 Phenylcarboxylic Acid Derivatives and Use Thereof for the Treatment of Diabetes MERCK PATENT GMBH (DE) 2008-02-21 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-20080045483-A1 Phenylcarboxylic Acid Derivatives and Use Thereof for the Treatment of Diabetes SLC5A1, ALDH7A1, ASS1 SMN1; SMN2 4522/4885LMNA 2120/4885KEAP1 1284/4885

“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.