SCHEMBL3554342

SCHEMBL3554342

CCS(=O)(=O)Nc1cccc(CCc2cccc(C(=O)O)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
HPGD P15428 1/20 0.51
POLB P06746 1/20 0.48
SLC16A3 O15427 5/20 0.47
ADRA2A P08913 1/20 0.47
ADRA1A P35348 1/20 0.47
FOLH1 Q04609 1/20 0.46
AKR1C3 P42330 2/20 0.46
HTR6 P50406 1/20 0.45
HIF1A Q16665 1/20 0.45
PFKFB3 Q16875 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL3564054 0.90 HPGD (0.57) LMNAHPGDSLC16A3FOLH1AKR1C3
SCHEMBL3555543 0.90 HPGD (0.50) LMNAHPGDADRA2AADRA1AHTR6
SCHEMBL3554833 0.89 AR (0.47) POLBSLC16A3
SCHEMBL4191220 0.88 LMNA (0.59) LMNAHPGDPOLBAKR1C3PFKFB3
SCHEMBL3560661 0.88 HPGD (0.53) HPGDPOLBSLC16A3AKR1C3HIF1A
SCHEMBL3557388 0.87 ALDH1A1 (0.57) HPGDPOLBSLC16A3FOLH1AKR1C3
SCHEMBL3557354 0.85 HPGD (0.55) LMNAHPGDFOLH1AKR1C3KMT2A
SCHEMBL3556961 0.84 SLC16A3 (0.47) POLBSLC16A3FOLH1AKR1C3HIF1A
SCHEMBL3558954 0.84 MEP1B (0.46) POLBSLC16A3FOLH1AKR1C3HTR6
SCHEMBL3555895 0.82 POLB (0.61) POLBSLC16A3HTR6PFKFB3KMT2A

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 LMNA 2120/4885HPGD 389/4885POLB 3962/4885

“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.