SCHEMBL3564236

SCHEMBL3564236

Cc1ccc(F)cc1S(=O)(=O)Nc1ccc(CCc2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 1/20 0.59
PTGER4 P35408 1/20 0.57
ALDH1A1 P00352 4/20 0.53
MAPT P10636 2/20 0.53
LMNA P02545 2/20 0.53
IDH1 O75874 6/20 0.53
CYP26A1 O43174 1/20 0.52
MEP1B Q16820 1/20 0.48
HTT P42858 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
SCHEMBL3554464 0.90 SLC16A3 (0.73) SLC16A3PTGER4ALDH1A1MAPTLMNA
SCHEMBL3559534 0.90 SLC16A3 (0.64) SLC16A3PTGER4ALDH1A1MAPTLMNA
SCHEMBL3561847 0.85 PTK2B (0.52) ALDH1A1LMNAHTT
SCHEMBL3554808 0.85 POLB (0.56) SLC16A3PTGER4ALDH1A1MAPTLMNA
SCHEMBL3556484 0.85 SLC16A3 (0.63) SLC16A3ALDH1A1MAPTIDH1
SCHEMBL3558027 0.85 SLC16A3 (0.81) SLC16A3ALDH1A1LMNAMEP1B
SCHEMBL3556263 0.82 SLC16A3 (0.74) SLC16A3ALDH1A1MAPTLMNAIDH1
SCHEMBL3563288 0.82 SLC16A3 (0.74) SLC16A3PTGER4ALDH1A1LMNAIDH1
SCHEMBL3561699 0.81 ALDH1A1 (0.59) PTGER4ALDH1A1MAPTLMNACYP26A1
SCHEMBL3560585 0.80 FFAR1 (0.63) ALDH1A1LMNA

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 425/4885PTGER4 174/4885ALDH1A1 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.