SCHEMBL15046439

SCHEMBL15046439

CC1(C)c2cc(/C=C/c3ccc4c(c3)C(C)(C)c3cc5c(cc3-4)C(C)(C)c3ccccc3N5c3ccc4ccccc4c3)ccc2-c2cc3c(cc21)N(c1ccc2ccccc2c1)c1ccccc1C3(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ RELA Q04206 1/20 0.35
▸ LMNA P02545 3/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ NQO2 P16083 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ PDK2 Q15119 2/20 0.32
▸ PTGS1 P23219 1/20 0.32
▸ EGLN1 Q9GZT9 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
SCHEMBL15046282 0.97 RELA (0.35) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL15046386 0.96 RELA (0.35) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL15046323 0.96 ALDH1A1 (0.33) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL15046335 0.94 RELA (0.33) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL15046267 0.94 RELA (0.33) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL15046360 0.93 RELA (0.33) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL15046280 0.91 ALDH1A1 (0.35) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL15046265 0.91 RELA (0.34) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL15046256 0.91 RELA (0.34) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL15046356 0.91 RELA (0.33) MAPTALDH1A1KMT2AHTTKDM4E

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-2013089460-A1 NOVEL CHEMICAL COMPOUND HAVING AN ACRIDINE STRUCTURE, AND ORGANIC LIGHT-EMITTING DIODE USING SAME 주식회사 두산 (KR) 2013-06-20 — — WO disclosed
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