SCHEMBL3557901

SCHEMBL3557901

O=C(O)c1cccc(CCCc2ccccc2NS(=O)(=O)c2ccccc2C(F)(F)F)c1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 7/20 0.64
MEN1 O00255 1/20 0.56
ALDH1A1 P00352 1/20 0.56
KMT2A Q03164 1/20 0.56
USP2 O75604 1/20 0.51
POLB P06746 1/20 0.51
SLC22A12 Q96S37 4/20 0.48
BCL2L1 Q07817 1/20 0.47
MCL1 Q07820 1/20 0.47
ALKBH2 Q6NS38 1/20 0.46
ALKBH3 Q96Q83 1/20 0.46
FTO Q9C0B1 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.46
SLC40A1 Q9NP59 1/20 0.44

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
SCHEMBL3562163 0.95 SLC16A3 (0.71) SLC16A3MEN1ALDH1A1KMT2AUSP2
SCHEMBL3566896 0.89 SLC16A3 (0.61) SLC16A3MEN1ALDH1A1KMT2APOLB
SCHEMBL3561067 0.86 SLC16A3 (0.67) SLC16A3MRGPRX4
SCHEMBL3555732 0.85 SLC16A3 (0.62) SLC16A3SLC22A12MRGPRX4SLC40A1
SCHEMBL3560873 0.85 MEN1 (0.73) SLC16A3MEN1ALDH1A1KMT2AUSP2
SCHEMBL3559492 0.85 SLC16A3 (0.64) SLC16A3MEN1KMT2AUSP2POLB
SCHEMBL3553876 0.85 SLC16A3 (0.70) SLC16A3MEN1KMT2AUSP2POLB
SCHEMBL3562402 0.84 SLC16A3 (0.63) SLC16A3MEN1KMT2AUSP2POLB
SCHEMBL3555480 0.84 SLC16A3 (0.59) SLC16A3USP2POLBMRGPRX4
SCHEMBL3557013 0.84 SLC16A3 (0.74) SLC16A3MEN1KMT2A

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 425/4885MEN1 2548/4885ALDH1A1 61/4885

“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.