SCHEMBL9972777

SCHEMBL9972777

COC(=O)c1cnn(C)c1/N=N/c1c(-c2ccccn2)nn(-c2cc(-n3nc(-c4ccccn4)c(/N=N/c4c(C(=O)CO)cnn4C)c3N)ncn2)c1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.42
▸ RAB9A P51151 5/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPT P10636 5/20 0.39
▸ LMNA P02545 3/20 0.39
▸ TP53 P04637 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ GABRG2 P18507 1/20 0.35
▸ GABRB3 P28472 1/20 0.35
▸ GABRA3 P34903 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ GRM5 P41594 2/20 0.33
▸ AXL P30530 1/20 0.33
▸ ATM Q13315 2/20 0.32
▸ PDE10A Q9Y233 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.31
▸ KLK3 P07288 1/20 0.31

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
SCHEMBL10454078 0.94 NPC1 (0.47) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL9972780 0.90 NPC1 (0.46) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL13159961 0.89 NPC1 (0.42) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL9972776 0.84 NPC1 (0.42) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL4068359 0.84 NPC1 (0.42) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10453845 0.84 NPC1 (0.51) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL15695692 0.82 NPC1 (0.40) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL9972806 0.82 NPC1 (0.47) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10331432 0.82 NPC1 (0.47) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10167755 0.82 NPC1 (0.40) NPC1RAB9AALDH1A1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8641785-B2 Aqueous pigment dispersion and aqueous ink for inkjet recording FUJIFILM CORPORATION (JP) 2014-02-04 — — US disclosed
US-8580025-B2 Ink set, recording method, recorded material and printed material FUJIFILM CORPORATION (JP) 2013-11-12 — — US disclosed
US-8500897-B2 Ink set, recorded material and printed material FUJIFILM CORPORATION (JP) 2013-08-06 — — US disclosed
US-8399545-B2 Azo pigment-containing aqueous ink for inkjet recording FUJIFILM CORPORATION (JP) 2013-03-19 — — US disclosed
US-8393725-B2 Ink set and image forming method FUJIFILM CORPORATION (JP) 2013-03-12 — — US disclosed
US-8348408-B2 Ink set and image forming method FUJIFILM CORPORATION (JP) 2013-01-08 — — US disclosed
US-8328344-B2 Aqueous ink composition for inkjet recording and image forming method FUJIFILM CORPORATION (JP) 2012-12-11 — — US disclosed
US-8222410-B2 Azo pigments, and pigment dispersion, coloring composition and ink for inkjet recording containing the azo pigment FUJIFILM CORPORATION (JP) 2012-07-17 — — US disclosed
US-20120165436-A1 PIGMENT DISPERSION CONTAINING AZO PIGMENT AND AQUEOUS INK FOR INKJET RECORDING USING THE SAME FUJIFILM CORPORATION (JP) 2012-06-28 — — US disclosed
US-20120165438-A1 AQUEOUS PIGMENT DISPERSION AND AQUEOUS INK FOR INK JET RECORDING FUJIFILM CORPORATION (JP) 2012-06-28 — — US disclosed
US-20120165437-A1 AQUEOUS PIGMENT DISPERSION AND AQUEOUS INK FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2012-06-28 — — US disclosed
US-20120156449-A1 INK SET, RECORDING METHOD, RECORDED MATERIAL AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2012-06-21 — — US disclosed
US-20110205289-A1 INK COMPOSITION, INK SET AND IMAGE FORMING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2011-08-25 — — US disclosed
US-20110166267-A1 AZO PIGMENT-CONTAINING AQUEOUS INK FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2011-07-07 — — US disclosed
US-20110050790-A1 INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-03-03 — — US disclosed
US-20110050789-A1 INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-03-03 — — US disclosed
US-20110050784-A1 AQUEOUS INK COMPOSITION FOR INKJET RECORDING AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-03-03 — — US disclosed
US-20110021763-A1 AZO PIGMENTS, AND PIGMENT DISPERSION, COLORING COMPOSITION AND INK FOR INKJET RECORDING CONTAINING THE AZO PIGMENT FUJIFILM CORPORATION (JP) 2011-01-27 — — US disclosed
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