SCHEMBL4068931

SCHEMBL4068931

Cc1nn(-c2cc(-n3nc(C)c(N=Nc4c(C(=O)O)cnn4C)c3N)ncn2)c(N)c1N=Nc1c(C=O)cnn1C

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ NPC1 O15118 7/20 0.33
▸ RAB9A P51151 7/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ SMN1; SMN2 Q16637 5/20 0.32
▸ TDP1 Q9NUW8 3/20 0.32
▸ HPGD P15428 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ KMT2A Q03164 3/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ MAPK1 P28482 2/20 0.31
▸ ALOX12 P18054 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL10332107 0.92 MAPT (0.38) MAPTCYP1A2CYP2C19RECQLNPC1
SCHEMBL11913354 0.84 NPC1 (0.32) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL10135965 0.84 RAB9A (0.41) MAPTCYP1A2CYP2C19RECQLNPC1
SCHEMBL9972797 0.84 RAB9A (0.41) MAPTCYP1A2CYP2C19RECQLNPC1
SCHEMBL9972799 0.84 RAB9A (0.36) MAPTCYP1A2CYP2C19RECQLNPC1
SCHEMBL13183216 0.84 MAPT (0.36) MAPTCYP1A2CYP2C19RECQLNPC1
SCHEMBL10453828 0.82 NPC1 (0.46) MAPTCYP1A2CYP2C19RECQLNPC1
SCHEMBL9972801 0.82 NPC1 (0.34) MAPTCYP1A2CYP2C19RECQLNPC1
SCHEMBL9972798 0.82 NPC1 (0.36) MAPTCYP1A2CYP2C19RECQLNPC1
SCHEMBL9972803 0.81 MAPK14 (0.42) MAPTCYP1A2CYP2C19RECQLNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8172910-B2 Azo pigment, process for producing azo pigment, and dispersion and coloring composition containing azo pigment FUJIFILM CORPORATION (JP) 2012-05-08 — — US disclosed
US-8080067-B2 Azo pigment composition, production process of azo pigment composition, dispersion containing azo pigment composition, coloring composition and ink for inkjet recording FUJIFILM CORPORATION (JP) 2011-12-20 — — US disclosed
US-20110179974-A1 AZO PIGMENT, PROCESS FOR PRODUCING AZO PIGMENT, AND DISPERSION AND COLORING COMPOSITION CONTAINING AZO PIGMENT FUJIFILM CORPORATION (JP) 2011-07-28 — — US disclosed
US-20110017099-A1 AZO PIGMENT COMPOSITION, PRODUCTION PROCESS OF AZO PIGMENT COMPOSITION, DISPERSION CONTAINING AZO PIGMENT COMPOSITION, COLORING COMPOSITION AND INK FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2011-01-27 — — US disclosed
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