SCHEMBL18084273

SCHEMBL18084273

CC(C)(c1ccc(Oc2ccc(N)cc2)cc1)c1ccc(Oc2ccc(N=NN)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.56
▸ ALDH1A1 P00352 6/20 0.56
▸ RAB9A P51151 5/20 0.56
▸ NPC1 O15118 3/20 0.56
▸ MAPK1 P28482 2/20 0.56
▸ HPGD P15428 1/20 0.56
▸ TDP1 Q9NUW8 4/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ TEAD4 Q15561 1/20 0.43
▸ POLB P06746 2/20 0.42
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MAOA P21397 2/20 0.40
▸ MAOB P27338 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MITF O75030 1/20 0.38
▸ GAA P10253 1/20 0.38

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
SCHEMBL18804018 0.92 MAPT (0.61) MAPTALDH1A1RAB9ANPC1MAPK1
SCHEMBL18804019 0.92 MAPT (0.61) MAPTALDH1A1RAB9ANPC1MAPK1
SCHEMBL18084259 0.90 MAPT (0.50) MAPTALDH1A1RAB9ANPC1MAPK1
SCHEMBL26840177 0.84 ALDH1A1 (0.76) MAPTALDH1A1RAB9ANPC1MAPK1
SCHEMBL49650 0.84 ALDH1A1 (0.76) MAPTALDH1A1RAB9ANPC1MAPK1
SCHEMBL5071236 0.84 ALDH1A1 (0.76) MAPTALDH1A1RAB9ANPC1MAPK1
SCHEMBL204685 0.84 ALDH1A1 (0.76) MAPTALDH1A1RAB9ANPC1MAPK1
SCHEMBL13836578 0.84 ALDH1A1 (0.76) MAPTALDH1A1RAB9ANPC1MAPK1
SCHEMBL2677985 0.84 ALDH1A1 (0.76) MAPTALDH1A1RAB9ANPC1MAPK1
SCHEMBL10391378 0.84 ALDH1A1 (0.76) MAPTALDH1A1RAB9ANPC1MAPK1

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-3064991-A1 LIQUID-CRYSTAL DISPLAY ELEMENT DIC Corporation (JP) 2016-09-07 — — EP disclosed
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