SCHEMBL26066397

SCHEMBL26066397

CC1(C)c2ccccc2-c2c(-c3ccccc3Nc3ccccc3-c3ccccc3)cccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FABP4 P15090 5/20 0.43
▸ FABP3 P05413 3/20 0.43
▸ FABP5 Q01469 1/20 0.43
▸ MYC P01106 2/20 0.36
▸ MAX P61244 1/20 0.36
▸ PDK2 Q15119 2/20 0.35
▸ BUB1 O43683 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ SIGMAR1 Q99720 1/20 0.34
▸ CXCR2 P25025 1/20 0.34
▸ CA12 O43570 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ MCOLN3 Q8TDD5 1/20 0.33
▸ CDC25B P30305 1/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ HTR7 P34969 1/20 0.33
▸ ADRA1A P35348 1/20 0.33
▸ PDK1 Q15118 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
SCHEMBL29598725 0.92 FABP4 (0.44) FABP4FABP3FABP5MYCMAX
SCHEMBL17777676 0.92 FABP4 (0.44) FABP4FABP3FABP5MYCMAX
SCHEMBL25124677 0.90 FABP4 (0.39) FABP4FABP3FABP5MYCMAX
SCHEMBL25125269 0.90 FABP4 (0.42) FABP4FABP3FABP5MYCMAX
SCHEMBL24969211 0.85 FABP4 (0.43) FABP4FABP3FABP5MYCMAX
SCHEMBL25124663 0.85 FABP4 (0.35) FABP4FABP3FABP5MYCMAX
SCHEMBL25124653 0.85 TYMS (0.36) FABP4FABP3FABP5MYCMAX
SCHEMBL25125102 0.84 FABP3 (0.40) FABP4FABP3FABP5MYCMAX
SCHEMBL15681332 0.84 POLB (0.33) PDK2BUB1
SCHEMBL22271342 0.84 ALDH1A1 (0.40) PDK2ADRA2AADRA1A

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-2023162947-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-08-31 — — WO disclosed
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