SCHEMBL29307516

SCHEMBL29307516

O=C(Nc1c[nH]c2ccc(Cl)cc12)C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ F7 P08709 1/20 0.51
▸ F3 P13726 1/20 0.51
▸ NR4A2 P43354 1/20 0.49
▸ STING1 Q86WV6 1/20 0.46
▸ NHERF1 O14745 5/20 0.45
▸ MTNR1A P48039 1/20 0.44
▸ MTNR1B P49286 1/20 0.44
▸ GPR84 Q9NQS5 1/20 0.43
▸ TRPV1 Q8NER1 1/20 0.42
▸ MMP9 P14780 1/20 0.42
▸ MMP8 P22894 1/20 0.42
▸ MMP14 P50281 1/20 0.42
▸ PYGL P06737 1/20 0.42
▸ GFER P55789 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ PDK1 Q15118 1/20 0.42
▸ PDK2 Q15119 1/20 0.42
▸ PDK3 Q15120 1/20 0.42
▸ PDK4 Q16654 1/20 0.42

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
SCHEMBL28847710 0.82 F7 (0.61) F7F3NR4A2STING1NHERF1
SCHEMBL7902669 0.81 MTNR1A (0.57) F7F3NR4A2STING1NHERF1
SCHEMBL30386394 0.81 F7 (0.55) F7F3NR4A2STING1NHERF1
SCHEMBL23167610 0.79 F7 (0.58) F7F3NR4A2STING1NHERF1
SCHEMBL24630105 0.78 NR4A2 (0.54) F7F3NR4A2STING1NHERF1
SCHEMBL30885411 0.78 STING1 (0.70) STING1NHERF1
SCHEMBL12545431 0.77 NR4A2 (0.52) F7F3NR4A2STING1NHERF1
SCHEMBL30218664 0.77 NR4A2 (0.52) F7F3NR4A2STING1NHERF1
SCHEMBL28991331 0.76 STING1 (0.52) F7F3STING1
SCHEMBL30386339 0.76 STING1 (0.52) F7F3STING1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12037325-B2 1,2-diaminobenzimidazole derivative CARNA BIOSCIENCES, INC. (JP) 2024-07-16 — — US disclosed
US-12037325-B2 1,2-diaminobenzimidazole derivative CARNA BIOSCIENCES, INC. (JP) 2024-07-16 — — US disclosed
US-12037325-B2 1,2-diaminobenzimidazole derivative CARNA BIOSCIENCES, INC. (JP) 2024-07-16 — — US disclosed
EP-4373811-A1 NOVEL 1,2-DIAMINOBENZIMIDAZOLE DERIVATIVE Carna Biosciences, Inc. (JP) 2024-05-29 — — EP disclosed
WO-2023053039-A1 NOVEL DIAMINOBENZIMIDAZOLE DERIVATIVE CARNA BIOSCIENCES, INC. (JP) 2023-04-06 — — WO disclosed
US-20230097964-A1 NOVEL 1,2-DIAMINOBENZIMIDAZOLE DERIVATIVE CARNA BIOSCIENCES, INC. (JP) 2023-03-30 — — US disclosed
WO-2023002246-A1 NOVEL 1,2-DIAMINOBENZIMIDAZOLE DERIVATIVE CARNA BIOSCIENCES, INC. (JP) 2023-01-26 — — 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 (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-12037325-B2 1,2-diaminobenzimidazole derivative STING1, TBK1, IRF3 F7 4728/4885F3 1905/4885NR4A2 953/4885
US-20230097964-A1 NOVEL 1,2-DIAMINOBENZIMIDAZOLE DERIVATIVE STING1, IRF3, TBK1 F7 4595/4885F3 1894/4885NR4A2 1083/4885

“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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