SCHEMBL3564174

SCHEMBL3564174

O=C(O)c1ccc(CCc2ccc(NS(=O)(=O)c3cccs3)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.64
RECQL P46063 1/20 0.64
MEN1 O00255 6/20 0.61
KMT2A Q03164 6/20 0.61
PKM P14618 2/20 0.61
LIMK2 P53671 1/20 0.61
HPGD P15428 2/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2D6 P10635 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
ALDH1A1 P00352 3/20 0.58
SMN1; SMN2 Q16637 1/20 0.53
HDAC1 Q13547 1/20 0.52
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.51
RORA P35398 1/20 0.51
RORC P51449 1/20 0.51
RORB Q92753 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
SCHEMBL8266867 0.92 MEN1 (0.66) LMNAMEN1KMT2APKMLIMK2
SCHEMBL3559462 0.89 LMNA (0.58) LMNARECQLMEN1KMT2APKM
SCHEMBL3563409 0.89 ALDH1A1 (0.66) LMNARECQLMEN1KMT2APKM
SCHEMBL3557796 0.84 SLC16A3 (0.61) LMNARECQLMEN1KMT2ALIMK2
SCHEMBL3557405 0.84 LMNA (0.58) LMNARECQLMEN1KMT2APKM
SCHEMBL3559245 0.84 MEN1 (0.65) LMNAMEN1KMT2APKMLIMK2
SCHEMBL20245200 0.81 LMNA (0.84) LMNARECQLMEN1KMT2APKM
SCHEMBL3563401 0.80 ALDH1A1 (0.67) LMNARECQLMEN1KMT2ALIMK2
SCHEMBL3556477 0.80 SLC16A3 (0.56) LMNARECQLMEN1KMT2APKM
SCHEMBL8290513 0.80 MEN1 (0.65) LMNAMEN1KMT2APKMLIMK2

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 2120/4885RECQL 2397/4885MEN1 2548/4885

“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.