SCHEMBL20239133

SCHEMBL20239133

N#Cc1cc(Oc2ccc(CS(N)(=O)=O)cc2)ccn1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.41
P2RX3 P56373 7/20 0.38
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA9 Q16790 2/20 0.37
CA5A P35218 1/20 0.37
ALOX5AP P20292 3/20 0.36
FEN1 P39748 3/20 0.36
SCN9A Q15858 1/20 0.36
MYC P01106 1/20 0.35
CA12 O43570 1/20 0.35
GRM2 Q14416 4/20 0.35

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
SCHEMBL18249754 0.83 KDR (0.41) KDRP2RX3SCN9AGRM2
SCHEMBL20239201 0.80 ST14 (0.40) P2RX3CA1CA2CA9CA5A
SCHEMBL20239263 0.79 P2RX3 (0.44) P2RX3CA1CA2CA9CA12
SCHEMBL1642799 0.76 ALDH1A1 (0.48) KDRALOX5APFEN1SCN9A
SCHEMBL3542289 0.75 FFAR1 (0.56)
SCHEMBL1680692 0.75 MEN1 (0.47) KDRALOX5APFEN1
SCHEMBL29770616 0.75 MEN1 (0.47) KDRALOX5APFEN1
SCHEMBL28895924 0.73 P2RX3 (0.41) P2RX3CA1CA2CA9CA12
SCHEMBL16738664 0.73 PDE2A (0.41) CA1CA2CA9CA5ASCN9A
SCHEMBL18249758 0.73 DGAT2 (0.41) P2RX3CA1CA2CA9CA5A

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
EP-3298001-B1 DGAT2 INHIBITORS LILLY CO ELI (US) 2020-05-13 EP disclosed
US-20180162825-A1 NOVEL DGAT2 INHIBITORS ELI LILY AND COMPANY (US) 2018-06-14 US disclosed
US-20180162825-A1 NOVEL DGAT2 INHIBITORS ELI LILY AND COMPANY (US) 2018-06-14 US disclosed
US-20180162825-A1 NOVEL DGAT2 INHIBITORS ELI LILY AND COMPANY (US) 2018-06-14 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-20180162825-A1 NOVEL DGAT2 INHIBITORS DGAT2, DGAT1, LCAT KDR 1382/4885P2RX3 2448/4885CA1 4849/4885

“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.