SCHEMBL3555732

SCHEMBL3555732

O=C(O)c1cccc(CCCc2ccccc2NS(=O)(=O)c2ccccc2OC(F)(F)F)c1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 8/20 0.62
SLC40A1 Q9NP59 1/20 0.47
RAD52 P43351 1/20 0.44
MRGPRX4 Q96LA9 2/20 0.42
MRGPRX1 Q96LB2 1/20 0.42
SLC22A12 Q96S37 2/20 0.41
ALPL P05186 1/20 0.41
PTK2B Q14289 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RAB9A P51151 1/20 0.41
IDH1 O75874 1/20 0.41

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
SCHEMBL3563150 0.95 SLC16A3 (0.68) SLC16A3SLC40A1RAD52MRGPRX4MRGPRX1
SCHEMBL3559725 0.89 SLC16A3 (0.58) SLC16A3SLC40A1RAD52MRGPRX1SLC22A12
SCHEMBL3551918 0.86 MEN1 (0.50) SLC16A3SLC40A1RAD52MRGPRX1SLC22A12
SCHEMBL3557901 0.85 SLC16A3 (0.64) SLC16A3SLC40A1MRGPRX4SLC22A12
SCHEMBL3558721 0.84 SLC16A3 (0.51) SLC16A3SLC22A12ALPLPTK2BIDH1
SCHEMBL3560779 0.84 SLC16A3 (0.64) SLC16A3SLC40A1RAD52MRGPRX1ALPL
SCHEMBL3561067 0.84 SLC16A3 (0.67) SLC16A3MRGPRX4PTK2BSMN1; SMN2RAB9A
SCHEMBL3555480 0.84 SLC16A3 (0.59) SLC16A3MRGPRX4PTK2BSMN1; SMN2RAB9A
SCHEMBL3554994 0.83 SLC16A3 (0.50) SLC16A3MRGPRX4SLC22A12ALPLPTK2B
SCHEMBL3557128 0.83 MEN1 (0.49) SLC16A3SLC40A1ALPL

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 425/4885SLC40A1 1414/4885RAD52 4737/4885

“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.