SCHEMBL3554684

SCHEMBL3554684

CCC(CC)C(=O)Nc1ccccc1CCCCCc1ccccc1C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 10/20 0.64
TSHR P16473 1/20 0.52
KDM4E B2RXH2 1/20 0.46
MAPK1 P28482 1/20 0.46
PTGER4 P35408 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
PLK1 P53350 3/20 0.44
PLK3 Q9H4B4 3/20 0.44
CLCN2 P51788 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
SCHEMBL3560469 0.92 SLC16A3 (0.58) SLC16A3TSHRMAPK1MEN1KMT2A
SCHEMBL3552416 0.89 SLC16A3 (0.62) SLC16A3KDM4EPTGER4KMT2APLK1
SCHEMBL3554752 0.88 SLC16A3 (0.68) SLC16A3PTGER4PLK1PLK3
SCHEMBL3559356 0.86 SLC16A3 (0.60) SLC16A3
SCHEMBL3561881 0.86 SLC16A3 (0.65) SLC16A3PTGER4PLK1PLK3CLCN2
SCHEMBL3561877 0.86 SLC16A3 (0.65) SLC16A3PTGER4PLK1PLK3CLCN2
SCHEMBL3558368 0.84 SLC16A3 (0.60) SLC16A3KDM4EPTGER4PLK1PLK3
SCHEMBL3555542 0.83 SLC16A3 (0.68) SLC16A3KDM4EKMT2APLK1PLK3
SCHEMBL3553748 0.81 SLC16A3 (0.65) SLC16A3MAPK1MEN1KMT2APLK1
SCHEMBL3556472 0.80 SLC16A3 (0.64) SLC16A3KDM4EKMT2A

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 425/4885TSHR 3483/4885KDM4E 1045/4885

“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.