SCHEMBL3557628

SCHEMBL3557628

COCC(=O)Nc1ccccc1CCCCCc1ccccc1C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 10/20 0.64
TSHR P16473 2/20 0.52
KDM4E B2RXH2 2/20 0.52
HSD17B10 Q99714 2/20 0.52
POLB P06746 1/20 0.51
HCAR2 Q8TDS4 1/20 0.50
GAA P10253 1/20 0.48
ALDH1A1 P00352 1/20 0.46
MAPK10 P53779 1/20 0.46
CYP2C19 P33261 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
SCHEMBL3553367 0.86 SLC16A3 (0.59) SLC16A3TSHRKDM4EHSD17B10POLB
SCHEMBL3555542 0.85 SLC16A3 (0.68) SLC16A3KDM4EPOLBALDH1A1KMT2A
SCHEMBL3554593 0.84 SLC16A3 (0.57) SLC16A3KDM4EHSD17B10POLBHCAR2
SCHEMBL3561577 0.84 SLC16A3 (0.66) SLC16A3KDM4EKMT2A
SCHEMBL3554353 0.84 SLC16A3 (0.66) SLC16A3KDM4EHCAR2ALDH1A1KMT2A
SCHEMBL3553748 0.83 SLC16A3 (0.65) SLC16A3ALDH1A1KMT2A
SCHEMBL3556472 0.82 SLC16A3 (0.64) SLC16A3KDM4EPOLBGAAALDH1A1
SCHEMBL3560444 0.82 SLC16A3 (0.64) SLC16A3GAAALDH1A1KMT2A
SCHEMBL6990712 0.82 KDM4E (0.72) TSHRKDM4EHSD17B10POLBHCAR2
SCHEMBL3554088 0.82 SLC16A3 (0.63) SLC16A3KDM4EGAAALDH1A1KMT2A

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.