SCHEMBL3553918

SCHEMBL3553918

O=C(O)c1ccccc1CCc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.59
ALDH1A1 P00352 2/20 0.53
LMNA P02545 1/20 0.53
CES1 P23141 1/20 0.52
AR P10275 1/20 0.52
HDAC1 Q13547 3/20 0.51
HDAC8 Q9BY41 2/20 0.51
PGR P06401 1/20 0.51
HDAC4 P56524 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
CCR1 P32246 1/20 0.50
CCR2 P41597 1/20 0.50
HTR6 P50406 1/20 0.50
TUBB P07437 1/20 0.49
AVPR2 P30518 1/20 0.49
GPR27 Q9NS67 1/20 0.49
HTT P42858 1/20 0.49
WDR5 P61964 1/20 0.49

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
SCHEMBL3556577 0.91 HDAC1 (0.60) ALDH1A1HDAC1HDAC8HDAC4MEN1
SCHEMBL3554424 0.89 UQCRB (0.56) ALDH1A1HDAC1HDAC8HDAC4MEN1
SCHEMBL3554803 0.89 SLC16A3 (0.57) ALDH1A1HDAC1HDAC8HDAC4MEN1
SCHEMBL3562024 0.88 SLC16A3 (0.58) ALDH1A1LMNAARHDAC1HDAC8
SCHEMBL3555122 0.88 ALDH1A1 (0.64) ALDH1A1LMNAARHDAC1HDAC8
SCHEMBL3557166 0.88 ALDH1A1 (0.60) ALDH1A1HDAC1HDAC8HDAC4MEN1
SCHEMBL3555671 0.88 METAP2 (0.57) ALDH1A1HDAC1HDAC8HDAC4MEN1
SCHEMBL3554566 0.87 MAPT (0.60) PRMT1ALDH1A1MEN1KMT2ACCR2
SCHEMBL3558130 0.87 HDAC8 (0.53) ALDH1A1LMNAHDAC1HDAC8HDAC4
SCHEMBL3558903 0.86 FFAR1 (0.59) ALDH1A1HDAC1HDAC8HDAC4HTR6

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 6 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
EP-1761486-A1 PHENYLCARBOXYLIC ACID DERIVATIVES AND USE THEREOF FOR THE TREATMENT OF DIABETES Merck Patent GmbH (DE) 2007-03-14 EP disclosed
WO-2006000288-A1 PHENYLCARBOXYLIC ACID DERIVATIVES AND USE THEREOF FOR THE TREATMENT OF DIABETES MERCK PATENT GMBH (DE) 2006-01-05 WO 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 PRMT1 839/4885ALDH1A1 61/4885LMNA 2120/4885

“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.