SCHEMBL3560646

SCHEMBL3560646

CS(=O)(=O)Nc1ccc(CCc2cccc(C(=O)O)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HPGD P15428 2/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
AKR1C3 P42330 2/20 0.48
SLC16A3 O15427 3/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PTGS2 P35354 2/20 0.47
NR3C2 P08235 1/20 0.47
POLB P06746 1/20 0.47
F2 P00734 1/20 0.47
F10 P00742 1/20 0.47
PRSS1 P07477 1/20 0.47
FOLH1 Q04609 1/20 0.46

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
SCHEMBL3557388 0.90 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2HPGDAKR1C3SLC16A3
SCHEMBL3564054 0.88 HPGD (0.57) CA1CA2SMN1; SMN2HPGDLMNA
SCHEMBL3559365 0.86 ALDH1A1 (0.52) KDM4EALDH1A1SMN1; SMN2HPGDKMT2A
SCHEMBL3552908 0.85 CA1 (0.46) CA1CA2AKR1C3SLC16A3MEN1
SCHEMBL3555520 0.85 KDM4E (0.59) KDM4EALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL3557393 0.84 HPGD (0.59) CA1CA2HPGDAKR1C3SLC16A3
SCHEMBL3552742 0.84 MEN1 (0.63) AKR1C3SLC16A3MEN1KMT2APOLB
SCHEMBL3552082 0.83 MEN1 (0.48) CA1CA2ALDH1A1SMN1; SMN2AKR1C3
SCHEMBL3557354 0.83 HPGD (0.55) KDM4ECA1CA2SMN1; SMN2HPGD
SCHEMBL3556522 0.83 SLC16A3 (0.58) CA1CA2ALDH1A1SLC16A3MEN1

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 KDM4E 1045/4885CA1 1700/4885CA2 1238/4885

“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.