SCHEMBL24549533

SCHEMBL24549533

CCCCc1ccc2c(c1)c1c(ccc3c4cc(CCCC)ccc4n(-c4ccccc4)c31)n2-c1nc(-c2ccc(-c3ccccc3)cc2)nc(-c2ccc(-c3cccc(-c4ccccc4)c3)cc2)n1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.35
▸ HSD11B1 P28845 2/20 0.35
▸ ADORA3 P0DMS8 3/20 0.34
▸ PSMB5 P28074 1/20 0.34
▸ EIF4A1 P60842 1/20 0.33
▸ EP300 Q09472 1/20 0.33
▸ KAT2A Q92830 1/20 0.33
▸ KAT2B Q92831 1/20 0.33
▸ TLR7 Q9NYK1 1/20 0.33
▸ UCHL3 P15374 1/20 0.32
▸ RORA P35398 1/20 0.32
▸ RORC P51449 1/20 0.32
▸ RORB Q92753 1/20 0.32
▸ PPARG P37231 1/20 0.32
▸ DHODH Q02127 1/20 0.32
▸ CTSD P07339 1/20 0.32

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
SCHEMBL23118651 1.00 PTPN1 (0.35) PTPN1HSD11B1ADORA3PSMB5EIF4A1
SCHEMBL23118652 0.99 PTPN1 (0.37) PTPN1HSD11B1ADORA3PSMB5EIF4A1
SCHEMBL23119044 0.98 PTPN1 (0.35) PTPN1HSD11B1ADORA3PSMB5EIF4A1
SCHEMBL23119043 0.98 PTPN1 (0.35) PTPN1HSD11B1ADORA3PSMB5EIF4A1
SCHEMBL23118986 0.97 HSD11B1 (0.37) HSD11B1ADORA3PSMB5EP300KAT2A
SCHEMBL23118564 0.96 PTPN1 (0.37) PTPN1HSD11B1ADORA3PSMB5EIF4A1
SCHEMBL24549537 0.95 PTPN1 (0.39) PTPN1HSD11B1ADORA3PSMB5EIF4A1
SCHEMBL23118988 0.95 PSMB5 (0.36) HSD11B1ADORA3PSMB5EP300KAT2A
SCHEMBL23118653 0.94 PTPN1 (0.37) PTPN1HSD11B1ADORA3PSMB5EIF4A1
SCHEMBL23118962 0.94 PTPN1 (0.37) PTPN1HSD11B1ADORA3PSMB5EIF4A1

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
US-20220199913-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2022-06-23 — — US disclosed
Send feedback