SCHEMBL23162014

SCHEMBL23162014

Nc1nc(-c2nn(Cc3ccccc3F)c3ccc(F)cc23)nc(N)c1N

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GUCY1A1 Q02108 15/20 0.51
GUCY1B1 Q02153 15/20 0.51
BUB1 O43683 2/20 0.45
ADORA3 P0DMS8 1/20 0.44
KCNH2 Q12809 1/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
GUCY1B2 O75343 1/20 0.42
GUCY1A2 P33402 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
SCHEMBL23161933 0.91 GUCY1A1 (0.59) GUCY1A1GUCY1B1
SCHEMBL23162015 0.86 GUCY1A1 (0.48) GUCY1A1GUCY1B1BUB1
SCHEMBL23162017 0.86 GUCY1A1 (0.48) GUCY1A1GUCY1B1BUB1
SCHEMBL28507109 0.85 GUCY1A1 (0.49) GUCY1A1GUCY1B1BUB1ADORA3KCNH2
SCHEMBL23161943 0.85 GUCY1A1 (0.51) GUCY1A1GUCY1B1BUB1ADORA3KCNH2
SCHEMBL23161910 0.84 ADORA3 (0.46) GUCY1A1GUCY1B1ADORA3KCNH2GUCY1B2
SCHEMBL23186737 0.83 KCNH2 (0.50) GUCY1A1GUCY1B1BUB1ADORA3KCNH2
SCHEMBL174875 0.82 PDE5A (0.59) GUCY1A1GUCY1B1ADORA3KCNH2
SCHEMBL23186736 0.81 KCNH2 (0.71) GUCY1A1GUCY1B1ADORA3KCNH2
SCHEMBL16643978 0.81 GUCY1A1 (0.65) GUCY1A1GUCY1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3609883-B1 FLUORINE-SUBSTITUTED INDAZOLE COMPOUNDS AND USES THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2022-06-29 EP disclosed
US-11242335-B2 Fluorine-substituted indazole compounds and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2022-02-08 US disclosed
US-20210101882-A1 FLUORINE-SUBSTITUTED INDAZOLE COMPOUNDS AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-04-08 US disclosed
CN-108727340-B Fluorine substituted indazoles and use thereof 广东东阳光药业有限公司 2020-12-29 CN 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-11242335-B2 Fluorine-substituted indazole compounds and uses thereof GUCY1B2, GUCY1A2, PDE3A GUCY1A1 8/4885GUCY1B1 5/4885BUB1 4073/4885
US-20210101882-A1 FLUORINE-SUBSTITUTED INDAZOLE COMPOUNDS AND USES THEREOF PDE3A, PDE3B, PDE5A GUCY1A1 16/4885GUCY1B1 12/4885BUB1 4579/4885

“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.