SCHEMBL20539304

SCHEMBL20539304

Cc1c(CO)cccc1-c1cncc(CO)c1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 7/20 0.58
▸ PDCD1 Q15116 5/20 0.58
▸ CYP2A6 P11509 1/20 0.52
▸ EPHX1 P07099 2/20 0.43
▸ CYP11B1 P15538 2/20 0.43
▸ CYP11B2 P19099 2/20 0.43
▸ S1PR1 P21453 1/20 0.39
▸ S1PR3 Q99500 1/20 0.39
▸ PRKCI P41743 1/20 0.38
▸ DYRK1A Q13627 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ SHMT1 P34896 1/20 0.36

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
SCHEMBL11074941 0.80 PDCD1 (0.69) CD274PDCD1CYP2A6EPHX1CYP11B1
SCHEMBL30091380 0.80 PDCD1 (0.69) CD274PDCD1CYP2A6EPHX1CYP11B1
SCHEMBL18367730 0.77 CD274 (0.70) CD274PDCD1EPHX1S1PR1S1PR3
SCHEMBL29558512 0.75 CD274 (1.00) CD274PDCD1EPHX1
SCHEMBL358303 0.75 CD274 (1.00) CD274PDCD1EPHX1
SCHEMBL12577749 0.74 CYP2A6 (0.54) CYP2A6CYP11B1CYP11B2S1PR1PRKCI
SCHEMBL16245269 0.74 PDCD1 (0.76) CD274PDCD1EPHX1S1PR1S1PR3
SCHEMBL21130363 0.72 PDCD1 (0.58) CD274PDCD1CYP2A6S1PR1S1PR3
SCHEMBL21130586 0.71 PDCD1 (0.53) CD274PDCD1CYP11B1CYP11B2S1PR1
SCHEMBL21130599 0.71 PDCD1 (0.53) CD274PDCD1CYP11B1CYP11B2S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12590062-B2 PD-1/PD-L1 inhibitors GILEAD SCIENCES, INC. (US) 2026-03-31 — — US disclosed
EP-4026835-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2022-07-13 — — EP disclosed
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
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
CN-110799509-A PD-1/PD-L1 inhibitors 吉利德科学公司 2020-02-14 — — CN 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 (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-20210323922-A1 PD-1/PD-L1 INHIBITORS CD274, PDCD1, PDCD1LG2 CD274 1/4885PDCD1 2/4885CYP2A6 3980/4885
US-12590062-B2 PD-1/PD-L1 inhibitors CD274, PDCD1LG2, PDCD1 CD274 1/4885PDCD1 3/4885CYP2A6 1049/4885
US-20180305315-A1 PD-1/PD-L1 INHIBITORS CD274, PDCD1, PDCD1LG2 CD274 1/4885PDCD1 2/4885CYP2A6 3980/4885

“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.

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