SCHEMBL20539296

SCHEMBL20539296

CS(=O)(=O)NC(=O)CNC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.37
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
CA2 P00918 1/20 0.32
MCL1 Q07820 1/20 0.32
NR4A2 P43354 1/20 0.31
CXCL8 P10145 1/20 0.31
NOTUM Q6P988 1/20 0.31
PTGES O14684 1/20 0.30

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
SCHEMBL1161320 0.78 EPHX2 (0.45) EPHX2CYP2D6CYP2C19MCL1NR4A2
SCHEMBL20539643 0.77 CA1 (0.38) CYP2D6CYP2C19CA2
SCHEMBL15934045 0.76 CA2 (0.46) EPHX2CA2
SCHEMBL18778812 0.75 LDHA (0.42) EPHX2CA2NR4A2CXCL8
SCHEMBL13901443 0.75 EPHX2 (0.34) EPHX2CXCL8
SCHEMBL18160817 0.74 EPHX2 (0.38) EPHX2CA2CXCL8PTGES
SCHEMBL22949988 0.73 TERT (0.39) EPHX2CA2MCL1CXCL8PTGES
SCHEMBL16003170 0.72 CA12 (0.46) CA2
SCHEMBL13269961 0.72 L3MBTL1 (0.35) CYP2D6CYP2C19CA2
SCHEMBL695182 0.72

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
EP-4026835-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2022-07-13 EP disclosed
US-20210323922-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. (US) 2021-10-21 US disclosed
EP-3612525-A1 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2020-02-26 EP disclosed
WO-2018195321-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. (US) 2018-10-25 WO disclosed
US-20180305315-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. 2018-10-25 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 (2 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-20210323922-A1 PD-1/PD-L1 INHIBITORS CD274, PDCD1, PDCD1LG2 EPHX2 3909/4885CYP2D6 1713/4885CYP2C19 3024/4885
US-20180305315-A1 PD-1/PD-L1 INHIBITORS CD274, PDCD1, PDCD1LG2 EPHX2 3909/4885CYP2D6 1713/4885CYP2C19 3024/4885

“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.