SCHEMBL25671868

SCHEMBL25671868

CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6ccccc6)cc5)ccc3n4-c3ccc(-c4cccc5ccccc45)cc3)cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 4/20 0.37
▸ CA1 P00915 4/20 0.37
▸ CA2 P00918 4/20 0.37
▸ CA9 Q16790 4/20 0.37
▸ KDM4E B2RXH2 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ALK Q9UM73 1/20 0.35
▸ PDK2 Q15119 3/20 0.34
▸ NTSR1 P30989 2/20 0.34
▸ TUBB4A P04350 1/20 0.34
▸ TUBB P07437 1/20 0.34
▸ TUBA3C P0DPH7 1/20 0.34
▸ TUBA1B P68363 1/20 0.34
▸ TUBA4A P68366 1/20 0.34
▸ TUBB4B P68371 1/20 0.34
▸ TUBB3 Q13509 1/20 0.34
▸ TUBB2A Q13885 1/20 0.34
▸ TUBB8 Q3ZCM7 1/20 0.34
▸ TUBA3E Q6PEY2 1/20 0.34

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
SCHEMBL18963080 0.95 CA12 (0.35) CA12CA1CA2CA9KDM4E
SCHEMBL23370376 0.94 CA12 (0.34) CA12CA1CA2CA9KDM4E
SCHEMBL18963079 0.93 CA12 (0.33) CA12CA1CA2CA9KDM4E
SCHEMBL13479108 0.93 TSPO (0.34) CA12CA1CA2CA9ALK
SCHEMBL17209187 0.93 CA12 (0.39) CA12CA1CA2CA9ALK
SCHEMBL17209163 0.93 CA12 (0.39) CA12CA1CA2CA9ALK
SCHEMBL17209170 0.93 CA12 (0.39) CA12CA1CA2CA9ALK
SCHEMBL17209191 0.93 CA12 (0.39) CA12CA1CA2CA9ALK
SCHEMBL22172964 0.92 KDM4E (0.39) KDM4EATML3MBTL1PDK2TSPO
SCHEMBL14212269 0.92 KDM4E (0.41) KDM4EATML3MBTL1PDK2TSPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230200233-A1 COMPOSITION, ELECTRONIC COMPOMENT AND ELECTRONIC DEVICE CONTAINING THE COMPOSITION SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 — — US disclosed
US-20230200233-A1 COMPOSITION, ELECTRONIC COMPOMENT AND ELECTRONIC DEVICE CONTAINING THE COMPOSITION SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 — — US disclosed
Send feedback