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SCHEMBL23764456

SCHEMBL23764456

CC(=N)c1ccccc1-c1cccc(N(c2ccccc2)c2ccc(-c3ccc4c5c(cccc35)-c3c-4c(-c4ccccc4)c4ccccc4c3-c3ccccc3)cc2)c1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.33
▸ ACMSD Q8TDX5 1/20 0.33
▸ LTB4R2 Q9NPC1 3/20 0.32
▸ CHRNB2 P17787 1/20 0.31
▸ CHRNB4 P30926 1/20 0.31
▸ CHRNA3 P32297 1/20 0.31
▸ CHRNA4 P43681 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ PPARG P37231 1/20 0.30
▸ PPARA Q07869 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
SCHEMBL23764462 1.00 MCL1 (0.33) MCL1ACMSDLTB4R2CHRNB2CHRNB4
SCHEMBL16484410 0.90 MCL1 (0.33) MCL1ACMSDCHRNB2CHRNB4CHRNA3
SCHEMBL23764081 0.87 GRIA2 (0.33) —
SCHEMBL23764376 0.85 LTB4R2 (0.37) MCL1ACMSDLTB4R2CHRNB2CHRNB4
SCHEMBL13085095 0.84 MCL1 (0.32) MCL1ACMSD
SCHEMBL12032283 0.84 ENPP1 (0.35) PPARGPPARA
SCHEMBL23764464 0.84 MCL1 (0.35) MCL1
SCHEMBL12032229 0.83 ENPP1 (0.35) MEN1KMT2APPARGPPARA
SCHEMBL4078983 0.83 ENPP1 (0.35) MEN1KMT2APPARGPPARA
SCHEMBL23764463 0.82 ENPP1 (0.33) —

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
EP-2907803-B1 FLUORANTHENE DERIVATIVE, LUMINESCENT ELEMENT MATERIAL CONTAINING SAME, AND LUMINESCENT ELEMENT TORAY INDUSTRIES (JP) 2021-08-18 — — EP disclosed
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