SCHEMBL3556516

SCHEMBL3556516

O=C(O)c1cccc(CCc2ccc(NS(=O)(=O)c3cccc4cccnc34)cc2)c1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.60
GAA P10253 1/20 0.60
FABP1 P07148 2/20 0.57
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
PKLR P30613 3/20 0.56
SMN1; SMN2 Q16637 1/20 0.55
TP53 P04637 1/20 0.54
HTT P42858 1/20 0.54
HDAC1 Q13547 1/20 0.53
SLC2A1 P11166 2/20 0.53
PKM P14618 1/20 0.53
SLC16A3 O15427 1/20 0.52
MMP2 P08253 1/20 0.51

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
SCHEMBL3558250 0.93 FABP1 (0.59) ALDH1A1GAAFABP1MEN1KMT2A
SCHEMBL3562540 0.85 SLC16A3 (0.73) ALDH1A1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL2702246 0.84 ALDH1A1 (0.76) ALDH1A1GAAFABP1MEN1KMT2A
SCHEMBL30708093 0.84 ALDH1A1 (0.76) ALDH1A1GAAFABP1MEN1KMT2A
SCHEMBL3559548 0.83 SLC16A3 (0.73) ALDH1A1MEN1KMT2AHTTHDAC1
SCHEMBL30705856 0.81 SLC2A1 (0.54) ALDH1A1GAAFABP1MEN1KMT2A
SCHEMBL29124084 0.81 SLC2A1 (0.54) ALDH1A1GAAFABP1MEN1KMT2A
SCHEMBL3560143 0.79 PTK2B (0.58) ALDH1A1MEN1KMT2ASMN1; SMN2SLC16A3
SCHEMBL3555597 0.79 FABP1 (0.74) ALDH1A1GAAFABP1MEN1KMT2A
SCHEMBL3554864 0.79 SLC16A3 (0.53) MEN1KMT2ASLC16A3

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 ALDH1A1 61/4885GAA 1191/4885FABP1 521/4885

“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.