SCHEMBL4068359

SCHEMBL4068359

COC(=O)c1cnn(C)c1N=Nc1c(C)nn(-c2cc(-n3nc(C)c(N=Nc4c(C(=O)CO)cnn4C)c3N)ncn2)c1N

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 7/20 0.42
▸ RAB9A P51151 6/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPT P10636 9/20 0.41
▸ LMNA P02545 2/20 0.41
▸ CYP1A2 P05177 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ RECQL P46063 1/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ KMT2A Q03164 2/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ HPGD P15428 2/20 0.32
▸ TP53 P04637 1/20 0.32
▸ TSHR P16473 1/20 0.31
▸ PDE1C Q14123 1/20 0.31
▸ SPR P35270 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ SLC34A1 Q06495 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
SCHEMBL9972776 1.00 NPC1 (0.42) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10453828 0.94 NPC1 (0.46) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL16503929 0.93 NPC1 (0.42) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL4068933 0.92 NPC1 (0.37) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL12759198 0.90 NPC1 (0.34) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL9972789 0.90 NPC1 (0.34) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL9972784 0.90 NPC1 (0.36) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL9972782 0.90 MAPT (0.36) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL9972811 0.90 NPC1 (0.43) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL9972808 0.89 NPC1 (0.43) 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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9365726-B2 Ink composition, inkset, recording apparatus, and recording method SEIKO EPSON CORPORATION (JP) 2016-06-14 — — US disclosed
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-20130201265-A1 INK COMPOSITION, INKSET, RECORDING APPARATUS, AND RECORDING METHOD SEIKO EPSON CORPORATION (JP) 2013-08-08 — — 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-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-20120165437-A1 AQUEOUS PIGMENT DISPERSION AND AQUEOUS INK FOR INKJET RECORDING 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-20120156449-A1 INK SET, RECORDING METHOD, RECORDED MATERIAL AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2012-06-21 — — US disclosed
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-20110166267-A1 AZO PIGMENT-CONTAINING AQUEOUS INK FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2011-07-07 — — 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
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
Send feedback