SCHEMBL20534385

SCHEMBL20534385

O=C(O)c1cnc(-c2nn(Cc3ccccc3F)c3c(F)cccc23)nc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BUB1 O43683 8/20 0.48
▸ ATM Q13315 1/20 0.47
▸ GUCY1A1 Q02108 1/20 0.44
▸ GUCY1B1 Q02153 1/20 0.44
▸ FABP3 P05413 1/20 0.43
▸ RORC P51449 1/20 0.43
▸ PDE5A O76074 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ FABP4 P15090 1/20 0.43
▸ ADORA3 P0DMS8 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ VNN1 O95497 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
SCHEMBL23161998 0.91 BUB1 (0.45) BUB1ATMGUCY1A1GUCY1B1PDE5A
SCHEMBL23161935 0.90 BUB1 (0.47) BUB1PDE5AADORA3KCNH2VNN1
SCHEMBL23161909 0.86 BUB1 (0.51) BUB1PDE5AADORA3KCNH2
SCHEMBL29637220 0.85 MEN1 (0.45) BUB1ALDH1A1VNN1
SCHEMBL20534749 0.85 MEN1 (0.45) BUB1ALDH1A1VNN1
SCHEMBL23162024 0.85 MAPT (0.45) BUB1KDM4EALDH1A1
SCHEMBL29637235 0.84 BUB1 (0.51) BUB1GUCY1A1GUCY1B1FABP3PDE5A
SCHEMBL23161926 0.84 BUB1 (0.51) BUB1GUCY1A1GUCY1B1FABP3PDE5A
SCHEMBL23161965 0.83 BUB1 (0.51) BUB1PDE5A
SCHEMBL23161899 0.81 BUB1 (0.51) BUB1ADORA3KCNH2

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
EP-3609883-B1 FLUORINE-SUBSTITUTED INDAZOLE COMPOUNDS AND USES THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2022-06-29 — — EP disclosed
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-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
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
EP-3609883-A1 FLUORINE-SUBSTITUTED INDAZOLE COMPOUNDS AND USES THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2020-02-19 — — EP disclosed
WO-2018188590-A1 FLUORINE-SUBSTITUTED INDAZOLE COMPOUNDS AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2018-10-18 — — 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-11242335-B2 Fluorine-substituted indazole compounds and uses thereof GUCY1B2, GUCY1A2, PDE3A BUB1 4073/4885ATM 1680/4885GUCY1A1 8/4885
US-20210101882-A1 FLUORINE-SUBSTITUTED INDAZOLE COMPOUNDS AND USES THEREOF PDE3A, PDE3B, PDE5A BUB1 4579/4885ATM 1132/4885GUCY1A1 16/4885

“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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