Sugi Predict

Sugi Predict / Compounds / SCHEMBL23917170

SCHEMBL23917170

SCHEMBL23917170

c1ccc(-n2c3ccc(-c4ccc5c(c4)c4c6ccccc6c6ccccc6c4n5-c4ccc(-c5ccc(-n6c7ccccc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccc9ccccc9c8)ccc76)cc5)cc4)cc3c3cc4ccccc4cc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ TSPO P30536 2/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ SIGMAR1 Q99720 1/20 0.32
▸ PTGER4 P35408 1/20 0.32
▸ PIK3CD O00329 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ MTOR P42345 1/20 0.32
▸ TUBB4A P04350 1/20 0.32
▸ TUBB P07437 1/20 0.32
▸ TUBA3C P0DPH7 1/20 0.32
▸ TUBA1B P68363 1/20 0.32
▸ TUBA4A P68366 1/20 0.32
▸ TUBB4B P68371 1/20 0.32
▸ TUBB3 Q13509 1/20 0.32
▸ TUBB2A Q13885 1/20 0.32
▸ TUBB8 Q3ZCM7 1/20 0.32
▸ TUBA3E Q6PEY2 1/20 0.32

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
SCHEMBL19844150 0.98 KDM4E (0.35) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL18667993 0.96 KDM4E (0.43) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL19131686 0.92 L3MBTL1 (0.37) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL19131235 0.91 L3MBTL1 (0.40) KDM4EATML3MBTL1TSPOSIGMAR1
SCHEMBL19844142 0.90 KDM4E (0.46) KDM4EATML3MBTL1HDAC4SIGMAR1
SCHEMBL18667990 0.90 KDM4E (0.36) KDM4EATML3MBTL1SIGMAR1TUBB4A
SCHEMBL20075327 0.89 JAK2 (0.34) KDM4EATML3MBTL1TSPOSIGMAR1
SCHEMBL17759970 0.89 L3MBTL1 (0.41) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL26154831 0.89 JAK2 (0.35) KDM4EATML3MBTL1PIK3CDPIK3CA
SCHEMBL19653581 0.89 L3MBTL1 (0.41) KDM4EATML3MBTL1TSPOHDAC4

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
US-11581497-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2023-02-14 — — US disclosed
US-11569458-B2 Metal complexes MERCK PATENT GMBH (DE) 2023-01-31 — — US disclosed
US-20220177478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK KGAA (DE) 2022-06-09 — — US disclosed
US-20210320264-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-10-14 — — 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-20220177478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, EPCAM, L1CAM KDM4E 1889/4885ATM 3068/4885L3MBTL1 1415/4885
US-11581497-B2 Materials for organic electroluminescent devices OR10J3, EPCAM, L1CAM KDM4E 2132/4885ATM 3016/4885L3MBTL1 1397/4885
US-20210320264-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, EPCAM, L1CAM KDM4E 2132/4885ATM 3016/4885L3MBTL1 1397/4885
US-11569458-B2 Metal complexes IMMT, MCU, SOD1 KDM4E 4470/4885ATM 4048/4885L3MBTL1 3259/4885

“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.