SCHEMBL26951812

SCHEMBL26951812

CC1(C)c2ccccc2-c2cc(-c3ccc4c(c3)CCCC4)c(Nc3ccc(-c4ccccc4)cc3)cc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ ATM Q13315 1/20 0.32
▸ PTGER4 P35408 1/20 0.32
▸ NPC1 O15118 3/20 0.32
▸ RAB9A P51151 3/20 0.32
▸ DHODH Q02127 1/20 0.32
▸ DGAT1 O75907 1/20 0.31
▸ ADRA2A P08913 1/20 0.31
▸ FFAR4 Q5NUL3 2/20 0.31
▸ TP53 P04637 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ NFKB2 Q00653 1/20 0.31
▸ RELA Q04206 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ MAPKAPK2 P49137 2/20 0.31

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
SCHEMBL26952585 0.89 CYP11B1 (0.34) CYP11B1CYP11B2MEN1KMT2AATM
SCHEMBL25524265 0.87 PTGER4 (0.37) MEN1KMT2APTGER4NFKB1SMN1; SMN2
SCHEMBL29662239 0.87 PTGER4 (0.37) MEN1KMT2APTGER4NFKB1SMN1; SMN2
SCHEMBL26952193 0.87 MEN1 (0.34) CYP11B1CYP11B2MEN1KMT2AATM
SCHEMBL15137673 0.83 PDK2 (0.41) PTGER4MAPKAPK2PDK2
SCHEMBL26951736 0.82 RARB (0.46) MEN1KMT2A
SCHEMBL25570548 0.82 PTGER4 (0.37) MEN1KMT2APTGER4NFKB1SMN1; SMN2
SCHEMBL26660392 0.82 MAPT (0.37) MEN1KMT2ATP53GAANFKB1
SCHEMBL30612824 0.82 MAPT (0.37) MEN1KMT2ATP53GAANFKB1
SCHEMBL26945044 0.79 CYP11B1 (0.33) CYP11B1CYP11B2FFAR4NLRP3

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-2023239091-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2023-12-14 — — WO disclosed
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