SCHEMBL26488461

SCHEMBL26488461

c1ccc(-c2ccccc2N(c2ccc(-c3cccc(-n4c5ccccc5c5cc6ccccc6cc54)c3-c3ccc4ccccc4c3)cc2)c2ccc(-c3cccc4ccccc34)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.32
AKT1 P31749 1/20 0.31
TUBB4A P04350 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31
TUBA1B P68363 1/20 0.31
TUBA4A P68366 1/20 0.31
TUBB4B P68371 1/20 0.31
TUBB3 Q13509 1/20 0.31
TUBB2A Q13885 1/20 0.31
TUBB8 Q3ZCM7 1/20 0.31
TUBA3E Q6PEY2 1/20 0.31
TUBA1A Q71U36 1/20 0.31
TUBA1C Q9BQE3 1/20 0.31
TUBB6 Q9BUF5 1/20 0.31
TUBB2B Q9BVA1 1/20 0.31
TUBB1 Q9H4B7 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL24949757 0.93 AKT1 (0.31) AKT1
SCHEMBL26487975 0.93 AKT1 (0.32) PIM1AKT1TUBB4ATUBBTUBA3C
SCHEMBL26488465 0.91 CA12 (0.32) CA12CA1CA2CA9PPARG
SCHEMBL24947472 0.90 CA12 (0.33) CA12CA1CA2CA9PPARG
SCHEMBL24949321 0.89 AKT1 (0.33) AKT1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL24947070 0.89 CA12 (0.35) CA12CA1CA2CA9PPARG
SCHEMBL26488259 0.89 AKT1 (0.33) AKT1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL26488235 0.89 AKT1 (0.33) AKT1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL26488114 0.89 AKT1 (0.33) AKT1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL26488363 0.89 AKT1 (0.33) PIM1AKT1TUBB4ATUBBTUBA3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023182836-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-09-28 WO disclosed