SCHEMBL3558403

SCHEMBL3558403

O=C(Nc1ccccc1CCCCCc1ccccc1C(=O)O)c1cccc(Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 10/20 1.00
MEN1 O00255 1/20 0.54
PKM P14618 1/20 0.54
KMT2A Q03164 1/20 0.54
SUCNR1 Q9BXA5 2/20 0.53
PYGL P06737 1/20 0.53
PYGM P11217 1/20 0.53
SERPINE1 P05121 1/20 0.51
AKR1C4 P17516 1/20 0.50
AKR1C3 P42330 1/20 0.50
AKR1C2 P52895 1/20 0.50
AKR1C1 Q04828 1/20 0.50
KCNK3 O14649 1/20 0.49
KCNK9 Q9NPC2 1/20 0.49
GRIK1 P39086 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
SCHEMBL3552419 0.91 SLC16A3 (0.83) SLC16A3MEN1KMT2A
SCHEMBL3559571 0.88 SLC16A3 (0.83) SLC16A3MEN1PKMKMT2AKCNK3
SCHEMBL3557714 0.87 SLC16A3 (0.78) SLC16A3MEN1KMT2ASUCNR1SERPINE1
SCHEMBL3554633 0.86 SLC16A3 (1.00) SLC16A3MEN1PKMKMT2A
SCHEMBL3557321 0.83 SLC16A3 (0.71) SLC16A3MEN1PKMKMT2APYGM
SCHEMBL3559506 0.82 SLC16A3 (1.00) SLC16A3
SCHEMBL1464661 0.82 MEN1 (0.79) SLC16A3MEN1PKMKMT2ASUCNR1
SCHEMBL3552458 0.82 SLC16A3 (1.00) SLC16A3MEN1KMT2A
SCHEMBL3564050 0.82 SLC16A3 (1.00) SLC16A3KMT2A
SCHEMBL3555922 0.81 SLC16A3 (0.69) SLC16A3MEN1PKMKMT2AGRIK1

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 2548/4885PKM 990/4885

“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.