SCHEMBL3498103

SCHEMBL3498103

COC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NS(=O)(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.60
POLB P06746 1/20 0.57
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
PPARG P37231 2/20 0.50
KDM4A O75164 1/20 0.50
BCL2 P10415 5/20 0.49
MCL1 Q07820 1/20 0.49
LTA4H P09960 1/20 0.49
USP2 O75604 1/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
CA12 O43570 2/20 0.45
CA7 P43166 2/20 0.45
CA9 Q16790 2/20 0.45
CA14 Q9ULX7 2/20 0.45
CA2 P00918 1/20 0.45
YAP1 P46937 2/20 0.45
MAPT P10636 1/20 0.44

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
SCHEMBL3498101 1.00 AR (0.60) ARPOLBMEN1KMT2APPARG
SCHEMBL31120596 0.91 POLB (0.67) ARPOLBMEN1KMT2AMMP2
SCHEMBL18379513 0.86 POLB (0.54) ARPOLBMEN1KMT2AMMP2
SCHEMBL3498441 0.84 AR (0.57) ARMEN1KMT2AKDM4ABCL2
SCHEMBL3498438 0.84 AR (0.57) ARMEN1KMT2AKDM4ABCL2
SCHEMBL6577060 0.82 PPARG (0.60) ARPOLBMEN1KMT2APPARG
SCHEMBL27466542 0.82 PPARG (0.60) ARPOLBMEN1KMT2APPARG
SCHEMBL6483680 0.81 AR (0.51) ARMEN1KMT2APPARGKDM4A
SCHEMBL8762284 0.81 AR (0.58) ARPOLBPPARGLTA4HMMP2
SCHEMBL21952415 0.79 CA1 (0.56) POLBMMP2MMP9CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130737-A1 Regulating Agent of GPR34 Receptor Function TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-27 US disclosed
EP-1849465-A1 AGENT FOR CONTROLLING FUNCTION OF GPR34 RECEPTOR Takeda Pharmaceutical Company Limited (JP) 2007-10-31 EP 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-20100130737-A1 Regulating Agent of GPR34 Receptor Function GPR34, GPR4, GPR6 AR 115/4885POLB 4658/4885MEN1 3918/4885

“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.