SCHEMBL4452983

SCHEMBL4452983

CNC(=O)C(NC(=O)c1cc(S(C)(=O)=O)ccc1Cl)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
PSMB5 P28074 1/20 0.49
TACR3 P29371 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 3/20 0.46
SMO Q99835 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
POLB P06746 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
S1PR3 Q99500 3/20 0.43
P2RX7 Q99572 1/20 0.42
TP53 P04637 1/20 0.42
SLC16A1 P53985 1/20 0.41
USP28 Q96RU2 1/20 0.41

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
SCHEMBL4447359 0.91 ITGB1 (0.50) LMNATACR3ALDH1A1SMOMEN1
SCHEMBL4454280 0.87 TACR3 (0.49) LMNATACR3ALDH1A1GAAMAPT
SCHEMBL4448302 0.84 PSMB5 (0.65) PSMB5TACR3SMN1; SMN2ALDH1A1MEN1
SCHEMBL14024226 0.76 MEN1 (0.54) PSMB5TACR3SMN1; SMN2ALDH1A1MEN1
SCHEMBL5322601 0.74 LMNA (0.61) LMNAALDH1A1SMOMEN1KMT2A
SCHEMBL7900707 0.72 SLC6A9 (0.68)
SCHEMBL4444765 0.71 S1PR3 (0.56) LMNATACR3SMN1; SMN2ALDH1A1CA1
SCHEMBL4443073 0.71 ALDH1A1 (0.56) LMNAPSMB5TACR3ALDH1A1MEN1
SCHEMBL34694 0.70 LMNA (1.00) LMNAALDH1A1MEN1KMT2AGAA
SCHEMBL4454245 0.70 TACR3 (0.54) TACR3SMN1; SMN2KMT2APOLBS1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090012010-A1 Amino acid derivatives as calcium channel blockers NEUROMED PHRAMACEUTICALS LTD. (CA) 2009-01-08 US disclosed
US-20090012010-A1 Amino acid derivatives as calcium channel blockers NEUROMED PHRAMACEUTICALS LTD. (CA) 2009-01-08 US disclosed
WO-2008141446-A1 AMINO ACID DERIVATIVES AS CALCIUM CHANNEL BLOCKERS NEUROMED PHARMACEUTICALS LTD. (CA) 2008-11-27 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-20090012010-A1 Amino acid derivatives as calcium channel blockers CACNA1G, CACNA1H, CACNA1I LMNA 1070/4885PSMB5 702/4885TACR3 556/4885

“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.