SCHEMBL21989487

SCHEMBL21989487

Nc1cc(C(=O)O)ncc1F

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.63
▸ ASPH Q12797 3/20 0.63
▸ KDM8 Q8N371 2/20 0.63
▸ KMO O15229 7/20 0.40
▸ P4HTM Q9NXG6 4/20 0.39
▸ P4HA1 P13674 1/20 0.39
▸ MIF P14174 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ KDM6B O15054 1/20 0.38
▸ TET3 O43151 1/20 0.38
▸ KDM4A O75164 1/20 0.38
▸ BBOX1 O75936 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ KDM5A P29375 1/20 0.38
▸ KDM5C P41229 1/20 0.38
▸ KDM4D Q6B0I6 1/20 0.38
▸ TET2 Q6N021 1/20 0.38
▸ ALKBH5 Q6P6C2 1/20 0.38
▸ KDM7A Q6ZMT4 1/20 0.38
▸ TET1 Q8NFU7 1/20 0.38

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
SCHEMBL18036225 0.84 KDM4E (0.44) KDM4EASPHKDM8SMN1; SMN2KMT2A
SCHEMBL27164868 0.81 KDM4E (0.70) KDM4EASPHKDM8KMOP4HTM
SCHEMBL3135116 0.81 KDM4E (0.48) KDM4EASPHKDM8KMOP4HTM
SCHEMBL31052884 0.81 KDM4E (0.48) KDM4EASPHKDM8KMOP4HTM
SCHEMBL31052887 0.81 KDM4E (0.48) KDM4EASPHKDM8KMOP4HTM
SCHEMBL31474566 0.79 KDM4E (0.68) KDM4EASPHKDM8KMOP4HTM
SCHEMBL24196273 0.78 PIK3CA (0.40) KDM4EASPHKDM8
SCHEMBL20638703 0.78 MAPK1 (0.50) KDM4EASPHKDM8ALDH1A1MAPT
SCHEMBL21989562 0.78 KDM4E (0.42) KDM4EASPHKDM8ALDH1A1MAPT
SCHEMBL5917874 0.78 KDM4E (0.46) KDM4EASPHKDM8P4HTMP4HA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11925631-B2 Substituted 6-azabenzimidazole compounds GILEAD SCIENCES, INC. (US) 2024-03-12 — — US disclosed
CN-117105933-A Substituted 6-azabenzimidazole compounds having HPK1 inhibitory activity 吉利德科学公司 2023-11-24 — — CN disclosed
CN-112969505-B Substituted 6-azabenzimidazole compounds having HPK1 inhibitory activity 吉利德科学公司 2023-11-14 — — CN disclosed
US-20230013585-A1 SUBSTITUTED 6-AZABENZIMIDAZOLE COMPOUNDS GILEAD SCIENCES, INC. 2023-01-19 — — US disclosed
US-20230013585-A1 SUBSTITUTED 6-AZABENZIMIDAZOLE COMPOUNDS GILEAD SCIENCES, INC. 2023-01-19 — — US disclosed
EP-3873608-A1 SUBSTITUTED 6-AZABENZIMIDAZOLE COMPOUNDS HAVING HPK1 INHIBITORY ACTIVITY GILEAD SCIENCES, INC. (US) 2021-09-08 — — EP disclosed
US-11071730-B2 Substituted 6-azabenzimidazole compounds GILEAD SCIENCES, INC. (US) 2021-07-27 — — US disclosed
US-11071730-B2 Substituted 6-azabenzimidazole compounds GILEAD SCIENCES, INC. (US) 2021-07-27 — — US disclosed
CN-112969505-A Substituted 6-azabenzimidazole compounds having HPK1 inhibiting activity 吉利德科学公司 2021-06-15 — — CN disclosed
US-20200171020-A1 SUBSTITUTED 6-AZABENZIMIDAZOLE COMPOUNDS GILEAD SCIENCES, INC. 2020-06-04 — — US disclosed
US-20200171020-A1 SUBSTITUTED 6-AZABENZIMIDAZOLE COMPOUNDS GILEAD SCIENCES, INC. 2020-06-04 — — US 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 (4 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-11925631-B2 Substituted 6-azabenzimidazole compounds CDK6, HIPK1, DCK KDM4E 1027/4885ASPH 3815/4885KDM8 949/4885
US-11071730-B2 Substituted 6-azabenzimidazole compounds CDK6, HIPK1, DCK KDM4E 1027/4885ASPH 3815/4885KDM8 949/4885
US-20200171020-A1 SUBSTITUTED 6-AZABENZIMIDAZOLE COMPOUNDS CDK6, HIPK1, DCK KDM4E 1027/4885ASPH 3815/4885KDM8 949/4885
US-20230013585-A1 SUBSTITUTED 6-AZABENZIMIDAZOLE COMPOUNDS CDK6, HIPK1, DCK KDM4E 1027/4885ASPH 3815/4885KDM8 949/4885

“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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