SCHEMBL27028503

SCHEMBL27028503

CCn1nc(C)cc1-c1cn(C)cn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 2/20 0.39
▸ ADORA2B P29275 1/20 0.38
▸ GAA P10253 1/20 0.36
▸ GLS O94925 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ AGTR1 P30556 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ TLR9 Q9NR96 1/20 0.36
▸ CYP2E1 P05181 1/20 0.35
▸ CYP2A6 P11509 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2B6 P20813 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ KRAS P01116 1/20 0.34
▸ HTR2C P28335 7/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ GLA P06280 1/20 0.33

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
SCHEMBL27028523 0.89 ADORA2B (0.37) S1PR1ADORA2BGAAGLSCYP2E1
SCHEMBL29889032 0.81 GAA (0.35) GAAGLSKMT2ACYP2E1CYP2A6
SCHEMBL27028473 0.79 MEN1 (0.35) GAAGLSMEN1KMT2ACYP2E1
SCHEMBL27028741 0.77 S1PR1 (0.38) S1PR1ADORA2BGAAMEN1NPC1
SCHEMBL29950605 0.77 GRIN2B (0.34) GAAMEN1KMT2ACYP2C9HTR2C
SCHEMBL27028474 0.77 KAT8 (0.31) —
SCHEMBL29889101 0.77 GRIN2B (0.34) GAAMEN1KMT2ACYP2C9HTR2C
SCHEMBL27028475 0.75 ADORA2B (0.40) S1PR1ADORA2BGAAGLSMEN1
SCHEMBL23115696 0.73 S1PR1 (0.42) S1PR1ADORA2BGAAGLSMEN1
SCHEMBL27028485 0.72 CYP2E1 (0.37) S1PR1GAAGLSCYP2E1CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240383903-A1 Modulators of STING (Stimulator of Interferon Genes) PFIZER INC. (US) 2024-11-21 — — US disclosed
US-11964978-B2 Modulators of STING (stimulator of interferon genes) PFIZER INC. (US) 2024-04-23 — — US disclosed
EP-4308563-A1 MODULATORS OF STING (STIMULATOR OF INTERFERON GENES) Pfizer Inc. (US) 2024-01-24 — — EP disclosed
CN-117321055-A Modulators of STING (interferon gene stimulators) 辉瑞公司 2023-12-29 — — CN disclosed
US-20220306641-A1 Modulators of STING (Stimulator of Interferon Genes) PFIZER INC. (US) 2022-09-29 — — US disclosed
WO-2022195462-A1 MODULATORS OF STING (STIMULATOR OF INTERFERON GENES) PFIZER INC. (US) 2022-09-22 — — 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 (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-11964978-B2 Modulators of STING (stimulator of interferon genes) STING1, IRF3, CGAS S1PR1 2542/4885ADORA2B 1784/4885GAA 372/4885
US-20220306641-A1 Modulators of STING (Stimulator of Interferon Genes) STING1, IRF3, CGAS S1PR1 2542/4885ADORA2B 1784/4885GAA 372/4885
US-20240383903-A1 Modulators of STING (Stimulator of Interferon Genes) STING1, IRF3, CGAS S1PR1 2542/4885ADORA2B 1784/4885GAA 372/4885

“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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