SCHEMBL27986562

SCHEMBL27986562

CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc2c3cccc4c(-c5ccccc5[N+](=O)[O-])ccc(c5ccc(C(N)=O)c1c52)c43

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.39
▸ LMNA P02545 1/20 0.39
▸ KCNMA1 Q12791 1/20 0.38
▸ GLA P06280 1/20 0.37
▸ USP2 O75604 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ MAPT P10636 1/20 0.35
▸ POLB P06746 3/20 0.35
▸ GAA P10253 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ CDC7 O00311 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
SCHEMBL28814631 0.90 KMT2A (0.35) KMT2ALMNAKCNMA1GLAUSP2
SCHEMBL27986198 0.85 LMNA (0.37) KMT2ALMNAKCNMA1GLAUSP2
SCHEMBL8654771 0.83 KMT2A (0.51) KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL28848988 0.80 KMT2A (0.46) KMT2ALMNAMEN1POLBSMN1; SMN2
SCHEMBL1566660 0.78 KMT2A (0.44) KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL5415825 0.77 KMT2A (0.37) KMT2ALMNAMEN1SMN1; SMN2
Valine SCHEMBL3631165 0.76 GLA (0.38) KMT2AGLAMEN1ALDH1A1POLB
SCHEMBL8473225 0.75 CYP1A2 (0.58) KMT2ALMNAKCNMA1MEN1ALDH1A1
SCHEMBL5415818 0.74 KMT2A (0.44) KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL29824483 0.73 KMT2A (0.56) KMT2ALMNAMEN1POLBSMN1; SMN2

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
CN-104245880-A RYLENE MONOIMIDE DERIVATES AND USE THEREOF AS PHOTOSENTIZERS IN SOLAR CELLS AND PHOTODETECTORS BASF SE 2014-12-24 — — CN disclosed
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