SCHEMBL27028475

SCHEMBL27028475

CCn1nc(C)cc1-c1c[nH]cn1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ADORA2B P29275 3/20 0.40
▸ S1PR1 P21453 2/20 0.38
▸ GAA P10253 1/20 0.36
▸ KRAS P01116 1/20 0.35
▸ GLS O94925 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ AGTR1 P30556 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ TLR9 Q9NR96 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ HTR2C P28335 5/20 0.32
▸ MAPT P10636 1/20 0.32
▸ ADORA2A P29274 2/20 0.32
▸ HTR2A P28223 2/20 0.31
▸ HTR2B P41595 2/20 0.31

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
SCHEMBL27028537 0.89 ADORA2B (0.36) ADORA2BGLSKDM4EALDH1A1GLA
SCHEMBL27200017 0.82 KCNJ6 (0.34) GLS
SCHEMBL27028481 0.82 GAA (0.34) GAAGLSKMT2AALDH1A1MAPT
SCHEMBL27200014 0.82 HPGD (0.34) GAAGLSMEN1KMT2AMAPT
SCHEMBL27200051 0.81 CRHR1 (0.35) GLSALDH1A1MAPT
SCHEMBL27200041 0.81 GLS (0.31) GLS
SCHEMBL27200031 0.80 MAP3K14 (0.35) ADORA2BGAAGLSKDM4EMAPT
SCHEMBL27200057 0.79 STIM1 (0.37) —
SCHEMBL27200074 0.79 KDM4E (0.31) KDM4E
SCHEMBL27028503 0.75 S1PR1 (0.39) ADORA2BS1PR1GAAKRASGLS

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 ADORA2B 1784/4885S1PR1 2542/4885GAA 372/4885
US-20220306641-A1 Modulators of STING (Stimulator of Interferon Genes) STING1, IRF3, CGAS ADORA2B 1784/4885S1PR1 2542/4885GAA 372/4885
US-20240383903-A1 Modulators of STING (Stimulator of Interferon Genes) STING1, IRF3, CGAS ADORA2B 1784/4885S1PR1 2542/4885GAA 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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