SCHEMBL24947394

SCHEMBL24947394

c1cc(-c2ccccc2N(c2ccc(-c3ccc4ccccc4c3)cc2)c2ccccc2-c2cccc3ccccc23)cc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.34
CA12 O43570 3/20 0.33
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
CA9 Q16790 3/20 0.33
TUBB4A P04350 1/20 0.33
TUBB P07437 1/20 0.33
TUBA3C P0DPH7 1/20 0.33
TUBA1B P68363 1/20 0.33
TUBA4A P68366 1/20 0.33
TUBB4B P68371 1/20 0.33
TUBB3 Q13509 1/20 0.33
TUBB2A Q13885 1/20 0.33
TUBB8 Q3ZCM7 1/20 0.33
TUBA3E Q6PEY2 1/20 0.33
TUBA1A Q71U36 1/20 0.33
TUBA1C Q9BQE3 1/20 0.33
TUBB6 Q9BUF5 1/20 0.33
TUBB2B Q9BVA1 1/20 0.33
TUBB1 Q9H4B7 1/20 0.33

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
SCHEMBL21971398 0.96 PIM1 (0.35) PIM1CA12CA1CA2CA9
SCHEMBL21972446 0.96 PIM1 (0.35) PIM1CA12CA1CA2CA9
SCHEMBL24947446 0.96 KDM4E (0.35) CA12CA1CA2CA9TUBB4A
SCHEMBL24948236 0.94 CA12 (0.33) PIM1CA12CA1CA2CA9
SCHEMBL24947136 0.94 CA12 (0.37) PIM1CA12CA1CA2CA9
SCHEMBL21971256 0.94 CA12 (0.37) PIM1CA12CA1CA2CA9
SCHEMBL24947443 0.94 KDM4E (0.36) CA12CA1CA2CA9TUBB4A
SCHEMBL24947410 0.94 CA12 (0.34) PIM1CA12CA1CA2CA9
SCHEMBL21971848 0.94 KDM4E (0.35) CA12CA1CA2CA9TUBB4A
SCHEMBL21971842 0.94 KDM4E (0.35) CA12CA1CA2CA9TUBB4A

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
WO-2023002447-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed
WO-2023003403-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed