SCHEMBL4569871

SCHEMBL4569871

Cc1cccc(S(=O)(=O)Nc2ccsc2C(=O)O)c1C

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.52
SLC10A6 Q3KNW5 1/20 0.47
EDNRA P25101 3/20 0.47
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
CYP3A4 P08684 2/20 0.45
HSD17B10 Q99714 1/20 0.45
TSHR P16473 1/20 0.44
KCNH2 Q12809 1/20 0.44
FABP4 P15090 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
TP53 P04637 1/20 0.42

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
SCHEMBL2158425 0.89 ACLY (0.54) ACLYSLC10A6EDNRAKDM4EMEN1
SCHEMBL7537977 0.81 ACLY (0.52) ACLYMEN1KMT2AHSD17B10TSHR
SCHEMBL2248038 0.79 ALDH1A1 (0.61) ACLYKDM4EMEN1KMT2AHSD17B10
SCHEMBL7537970 0.79 ACLY (0.50) ACLYKDM4EMEN1KMT2AHSD17B10
SCHEMBL7531342 0.78 ACLY (0.54) ACLYSLC10A6KDM4EMEN1KMT2A
SCHEMBL6611218 0.78 SLC40A1 (0.47) ACLYSLC10A6EDNRAKDM4EMEN1
SCHEMBL2747643 0.77 ACLY (0.53) ACLYEDNRAKDM4EMEN1KMT2A
SCHEMBL11246570 0.77 ALDH1A1 (0.68) KDM4EMEN1KMT2ACYP3A4HSD17B10
SCHEMBL2747710 0.77 ACLY (0.59) ACLYKDM4ETSHR
SCHEMBL2748302 0.76 ACLY (0.55) ACLYEDNRAKDM4EMEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120269864-A1 Arginine Derivatives with NP-I Antagonistic Activity GB06/019611.7 THERAPIES LIMITED (GB) 2012-10-25 US disclosed
US-8227606-B2 Arginine derivatives with NP-1 antagonistic activity ARK THERAPEUTICS, LTD. (GB) 2012-07-24 US disclosed
US-20120122862-A1 ARGININE DERIVATIVES WITH NP-I ANTAGONISTIC ACTIVITY GB06/019611.7 THERAPIES LIMITED (GB) 2012-05-17 US disclosed
US-8158789-B2 Arginine derivatives with NP-I antagonistic activity Ark Therapeutics Group Ltd. (GB) 2012-04-17 US disclosed
US-20100022525-A1 Arginine Derivatives with NP-I Antagonistic Activity GB06/019611.7 THERAPIES LIMITED (GB) 2010-01-28 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 (3 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-20120269864-A1 Arginine Derivatives with NP-I Antagonistic Activity NPFFR1, NPR1, ARG1 ACLY 3169/4885SLC10A6 1440/4885EDNRA 18/4885
US-20120122862-A1 ARGININE DERIVATIVES WITH NP-I ANTAGONISTIC ACTIVITY NPFFR1, NPR1, ARG1 ACLY 3169/4885SLC10A6 1440/4885EDNRA 18/4885
US-20100022525-A1 Arginine Derivatives with NP-I Antagonistic Activity NPFFR1, NPR1, ARG1 ACLY 3169/4885SLC10A6 1440/4885EDNRA 18/4885

“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.