SCHEMBL3556737

SCHEMBL3556737

O=C(O)c1ccccc1CCc1cccc(NS(=O)(=O)c2ccc(F)cc2F)c1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 5/20 0.53
FABP4 P15090 7/20 0.50
FABP5 Q01469 4/20 0.50
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.45
HTR6 P50406 2/20 0.45
PTK2B Q14289 1/20 0.45
IDH1 O75874 2/20 0.43

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
SCHEMBL3554621 0.90 PTK2B (0.50) SLC16A3FABP4HTR6PTK2BIDH1
SCHEMBL3553690 0.89 FABP4 (0.52) SLC16A3FABP4FABP5KDM4EPTK2B
SCHEMBL3550800 0.88 SLC16A3 (0.69) SLC16A3FABP4FABP5LMNAIDH1
SCHEMBL3556820 0.87 SLC16A3 (0.57) SLC16A3FABP4FABP5LMNAHTR6
SCHEMBL3556257 0.86 SLC16A3 (0.67) SLC16A3LMNAHTR6
SCHEMBL3559120 0.85 SLC16A3 (0.54) SLC16A3LMNAHTR6
SCHEMBL3555571 0.85 SLC16A3 (0.48) SLC16A3FABP4HTR6PTK2BIDH1
SCHEMBL3560292 0.84 PTK2B (0.50) SLC16A3FABP4FABP5LMNAHTR6
SCHEMBL3560058 0.84 SLC16A3 (0.58) SLC16A3FABP4FABP5KDM4EPTK2B
SCHEMBL3561338 0.82 HTR6 (0.62) SLC16A3HTR6

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 SLC16A3 425/4885FABP4 251/4885FABP5 799/4885

“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.