SCHEMBL30022592

SCHEMBL30022592

CC(C)(C)c1ccccc1-c1ccccn1.CC(C)(C)c1ccccc1-c1ccccn1.CC(C)(C)c1ccccc1-c1ccccn1.[Ir+3]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.48
▸ LMNA P02545 3/20 0.48
▸ CCR1 P32246 2/20 0.48
▸ CCR5 P51681 2/20 0.48
▸ CCR8 P51685 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ METAP1 P53582 1/20 0.48
▸ BLM P54132 1/20 0.48
▸ HIF1A Q16665 1/20 0.48
▸ DOHH Q9BU89 1/20 0.48
▸ P4HTM Q9NXG6 1/20 0.48
▸ NPC1 O15118 6/20 0.42
▸ RAB9A P51151 5/20 0.42
▸ TP53 P04637 3/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ TDP1 Q9NUW8 3/20 0.42
▸ ALOX15 P16050 2/20 0.42
▸ HTT P42858 2/20 0.42

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
SCHEMBL9258894 0.98 KDM4E (0.50) KDM4ELMNACCR1CCR5CCR8
SCHEMBL28440324 0.84 KDM4E (0.43) KDM4ELMNACCR1CCR5CCR8
SCHEMBL17194970 0.84 KDM4E (0.43) KDM4ELMNACCR1CCR5CCR8
SCHEMBL8898797 0.81 KDM4E (0.44) KDM4ELMNACCR1CCR5CCR8
SCHEMBL29721294 0.80 KDM4E (0.52) KDM4ELMNACCR1CCR5CCR8
SCHEMBL18415019 0.80 SMN1; SMN2 (0.45) KDM4ELMNACCR1CCR5CCR8
SCHEMBL19229871 0.79 KDM4E (0.44) KDM4ELMNACCR1CCR5CCR8
SCHEMBL12204551 0.79 METAP2 (0.50) KDM4ELMNACCR1CCR5CCR8
SCHEMBL4166620 0.78 TGFBR1 (0.56) KDM4ELMNACCR1CCR5CCR8
SCHEMBL30090604 0.78 TGFBR1 (0.56) KDM4ELMNACCR1CCR5CCR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022270428-A1 MIXED POWDER FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND METHOD FOR MANUFACTURING MIXED POWDER, METHOD FOR MANUFACTURING ORGANIC ELECTROLUMINESCENT ELEMENT USING MIXED POWDER, METHOD FOR SELECTING COMPOUND IN MIXED POWDER, AND COMPOSITION FOR VACUUM DEPOSITION 出光興産株式会社 2022-12-29 — — WO disclosed
WO-2022270423-A1 MIXED POWDER FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND METHOD FOR MANUFACTURING MIXED POWDER, METHOD FOR MANUFACTURING ORGANIC ELECTROLUMINESCENT ELEMENT USING MIXED POWDER, METHOD FOR SELECTING COMPOUND IN MIXED POWDER, AND COMPOSITION FOR VACUUM DEPOSITION 出光興産株式会社 2022-12-29 — — WO disclosed
WO-2022244864-A1 MIXED POWDER, VAPOR DEPOSITION METHOD FOR ORGANIC COMPOUND, METHOD FOR PRODUCING ORGANIC ELECTROLUMINESCENT ELEMENT, METHOD FOR SELECTING ORGANIC COMPOUND, AND VAPOR DEPOSITION METHOD 出光興産株式会社 2022-11-24 — — WO disclosed
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