SCHEMBL9438061

SCHEMBL9438061

Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2c(Nc4ccc(Cl)cc4)ccc(Nc4ccc(Cl)cc4)c2C3=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ MAPT P10636 5/20 0.46
▸ MEN1 O00255 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ MITF O75030 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ EGFR P00533 1/20 0.45
▸ POLB P06746 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ PTGS2 P35354 2/20 0.42
▸ TDP1 Q9NUW8 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ GAA P10253 2/20 0.42
▸ APP P05067 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ CASP6 P55212 1/20 0.42
▸ ELAVL1 Q15717 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL9438094 1.00 RAB9A (0.47) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL9438085 0.91 NPC1 (0.55) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL10587639 0.91 LMNA (0.44) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL10587610 0.88 MEN1 (0.41) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL11605009 0.81 CYP1A2 (0.53) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL11605334 0.81 MAPT (0.51) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL11398684 0.81 CYP1A2 (0.53) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL7928173 0.81 CYP1A2 (0.53) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL10812766 0.80 ADORA2A (0.46) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL35556 0.79 P2RY2 (0.60) RAB9ANPC1MAPTMEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5342974-A Reacting 1,4,5,8-tetrachloroanthraquione with monohalogenated aniline in presence of carboxylic acid salt, benzyl alcohol and copper catalyst MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1994-08-30 — — US disclosed
EP-0323184-B1 Halogenated anthraquinones useful as near infrared absorbing optical filters, and method of making them MITSUI TOATSU CHEMICALS (JP) 1994-03-09 — — EP disclosed
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